SCHEMBL1244590

SCHEMBL1244590

CCOC(=O)c1cc2sc(Br)cc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.51
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HSD17B10 Q99714 1/20 0.51
LMNA P02545 4/20 0.50
NPC1 O15118 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GLA P06280 1/20 0.50
GAA P10253 1/20 0.50
ATM Q13315 1/20 0.50
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
HTT P42858 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
MMP13 P45452 7/20 0.47
MMP2 P08253 5/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22688131 0.84 CYP1A2 (0.44) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL18034454 0.84 ALDH1A1 (0.54) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL1244713 0.84 ALDH1A1 (0.54) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL1244756 0.82 ALOX15 (0.56) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL1245047 0.82 ALDH1A1 (0.51) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL15850382 0.82 ALDH1A1 (0.51) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL31229530 0.81 ALDH1A1 (0.56) KDM4EALDH1A1HPGDLMNANPC1
SCHEMBL6626487 0.79 ALDH1A1 (0.49) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6625018 0.79 KDM4E (0.49) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL24038046 0.78 RAB9A (0.48) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118434822-A Powdery pigment composition, method for producing powdery pigment composition, resin composition, and molded article DIC株式会社 2024-08-02 CN disclosed
US-11981680-B2 Substituted thienopyrroles as PAD4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-05-14 US disclosed
EP-3833671-B1 SUBSTITUTED THIENOPYRROLES AS PAD4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2022-08-24 EP disclosed
US-20220127267-A1 THIENO[3,2-B] PYRROLE[3,2-D]PYRIDAZINONE DERIVATIVES AND THEIR USE AS PKM2 DERIVATIVES FOR THE TREATMENT OF CANCER, OBESITY AND DIABETES RELATED DISORDERS AGIOS PHARMACEUTICALS INC (US) 2022-04-28 US disclosed
US-20220064180-A1 SUBSTITUTED THIENOPYRROLES AS PAD4 INHIBITORS LG ENERGY SOLUTION, LTD. (KR) 2022-03-03 US disclosed
EP-3924056-A1 THIENO[3,2-B] PYRROLE[3,2-D]PYRIDAZINONE DERIVATIVES AND THEIR USE AS PKM2 DERIVATIVES FOR THE TREATMENT OF CANCER, OBESITY AND DIABETES RELATED DISORDERS Agios Pharmaceuticals, Inc. (US) 2021-12-22 EP disclosed
CN-113646050-A Thieno [3,2-B ] pyrrolo [3,2-D ] pyridazinone derivatives and their use as PKM2 derivatives for the treatment of cancer, obesity and diabetes related disorders 安吉奥斯医药品有限公司 2021-11-12 CN disclosed
EP-3833671-A1 SUBSTITUTED THIENOPYRROLES AS PAD4 INHIBITORS Bristol-Myers Squibb Company (US) 2021-06-16 EP disclosed
WO-2020167976-A1 THIENO[3,2-B] PYRROLE[3,2-D]PYRIDAZINONE DERIVATIVES AND THEIR USE AS PKM2 DERIVATIVES FOR THE TREATMENT OF CANCER, OBESITY AND DIABETES RELATED DISORDERS AGIOS PHARMACEUTICALS, INC. (US) 2020-08-20 WO disclosed
WO-2020033490-A1 SUBSTITUTED THIENOPYRROLES AS PAD4 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2020-02-13 WO disclosed
WO-2007039773-A1 USE OF FUSED PYRROLE CARBOXYLIC ACIDS FOR THE TREATMENT OF NEURODEGENERATIVE AND PSYCHIATRIC DISEASES AS D-AMINO ACID OXIDASE INHIBITORS MERCK SHARP & DOHME LIMITED (GB) 2007-04-12 WO disclosed
US-6828343-B2 For therapy and prophylaxis of atherosclerosis, diabetes, insulin resistance, diabetic neuropathy, diabetic nephropathy, diabetic retinopathy, cataracts, hypercholesterolemia, hypertriglyceridemia, hyperlipidemia, hyperglycemia PFIZER, INC. 2004-12-07 US disclosed
EP-1391460-A1 Tricyclic pyrrolyl amides as glycogen phosphorylase inhibitors Pfizer Products Inc. (US) 2004-02-25 EP disclosed
EP-1088824-B1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PFIZER PROD INC (US) 2004-01-07 EP disclosed
US-20030195361-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PFIZER INC. 2003-10-16 US disclosed
US-6576653-B2 For therapy of diabetes, insulin resistance, diabetic neuropathy, diabetic nephropathy, diabetic retinopathy, cataracts, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemia, hyperlipidemia, atherosclerosis PFIZER INC. 2003-06-10 US disclosed
US-20030004162-A1 Use of glycogen phosphorylase inhibitors TREADWAY JUDITH L (US) 2003-01-02 US disclosed
US-20020183369-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors DU BOIS DAISY JOE (US) 2002-12-05 US disclosed
EP-1136071-A2 Use of glycogen phosphorylase inhibitors Pfizer Products Inc. (US) 2001-09-26 EP disclosed
EP-1088824-A2 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors Pfizer Products Inc. (US) 2001-04-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220127267-A1 THIENO[3,2-B] PYRROLE[3,2-D]PYRIDAZINONE DERIVATIVES AND THEIR USE AS PKM2 DERIVATIVES FOR THE TREATMENT OF CANCER, OBESITY AND DIABETES RELATED DISORDERS PDK2, PDK1, PDK3 RAB9A 3825/4885KDM4E 480/4885ALDH1A1 509/4885
US-20220064180-A1 SUBSTITUTED THIENOPYRROLES AS PAD4 INHIBITORS PADI4, PADI1, PADI6 RAB9A 4487/4885KDM4E 120/4885ALDH1A1 142/4885
US-20030195361-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PYGL, GYS1, PYGM RAB9A 3214/4885KDM4E 3388/4885ALDH1A1 1450/4885
US-20020183369-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PYGL, PYGM, PYGB RAB9A 4025/4885KDM4E 2517/4885ALDH1A1 1268/4885
US-20030004162-A1 Use of glycogen phosphorylase inhibitors PYGL, PYGM, GYS2 RAB9A 4822/4885KDM4E 2087/4885ALDH1A1 2056/4885
US-11981680-B2 Substituted thienopyrroles as PAD4 inhibitors PADI4, PADI1, PADI6 RAB9A 4487/4885KDM4E 120/4885ALDH1A1 142/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.