SCHEMBL1244597

SCHEMBL1244597

CCOC(=O)c1cc2occ(Br)c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 5/20 0.42
MAPT P10636 5/20 0.42
NPC1 O15118 2/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
GLA P06280 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
ALOX15 P16050 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
DAO P14920 1/20 0.40
CDK1 P06493 1/20 0.40
CCNB1 P14635 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL1244837 0.85 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1244068 0.84 DAO (0.46) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL12777569 0.84 KDM4E (0.43) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1244792 0.83 DAO (0.61) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1244910 0.83 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1245049 0.82 CDK1 (0.44) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1243956 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1244191 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1245203 0.80 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDRAB9ASMN1; SMN2
SCHEMBL1242514 0.80 KDM4E (0.40) ALDH1A1KDM4EHPGDRAB9ASMN1; 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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-7884124-B2 such as 2-Fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate acid, used for the treatment of neuropathic pain, Alzheimer's disease, schizophrenia, ataxia and convulsions SEPRACOR INC. (US) 2011-02-08 US disclosed
US-20090306169-A1 Use of Fused Pyrrole Carboxylic Acids for the Treatment of Neurodegenerative and Psychiatric Diseases and D-Amino Acid Oxidase Inhibitors BRANDISH PHILIP E 2009-12-10 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
US-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC. (US) 2008-03-06 US disclosed
WO-2008005456-A2 FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-10 WO disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 US disclosed
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2008-01-03 US 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
US-6399601-B1 ANTIDIABETIC AGENTS; NERVOUS SYSTEM DISORDERS; ANTICHOLESTEROL AGENTS PFIZER INC. 2002-06-04 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-20080058395-A1 Fused heterocyclic inhibitors of D-amino acid oxidase DAO, DDO, AOX1 ALDH1A1 866/4885KDM4E 2644/4885HPGD 1217/4885
US-20090306169-A1 Use of Fused Pyrrole Carboxylic Acids for the Treatment of Neurodegenerative and Psychiatric Diseases and D-Amino Acid Oxidase Inhibitors DAO, DDO, MAOB ALDH1A1 337/4885KDM4E 1526/4885HPGD 108/4885
US-20030195361-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PYGL, GYS1, PYGM ALDH1A1 1450/4885KDM4E 3388/4885HPGD 797/4885
US-20020183369-A1 Bicyclic pyrrolyl amides as glycogen phosphorylase inhibitors PYGL, PYGM, PYGB ALDH1A1 1268/4885KDM4E 2517/4885HPGD 697/4885
US-20030004162-A1 Use of glycogen phosphorylase inhibitors PYGL, PYGM, GYS2 ALDH1A1 2056/4885KDM4E 2087/4885HPGD 1139/4885
US-20080004327-A1 FLUORO-SUBSTITUTED INHIBITORS OF D-AMINO ACID OXIDASE DAO, DDO, AOX1 ALDH1A1 622/4885KDM4E 2046/4885HPGD 2178/4885

“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.