SCHEMBL12349885

SCHEMBL12349885

Cc1c(-c2ccccc2)nc2ccccn12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.76
RAB9A P51151 4/20 0.76
KDM4E B2RXH2 3/20 0.76
MAPT P10636 1/20 0.76
ADRA1B P35368 1/20 0.58
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NTRK1 P04629 2/20 0.54
ALDH1A1 P00352 5/20 0.53
HPGD P15428 2/20 0.52
HSD17B10 Q99714 2/20 0.52
PKM P14618 1/20 0.52
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
SLC2A1 P11166 1/20 0.48
TOP2A P11388 1/20 0.48

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
SCHEMBL15382775 0.92 NPC1 (0.70) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL14646318 0.89 NPC1 (0.77) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL22627455 0.88 KDM4E (0.69) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL15382821 0.87 RAB9A (0.63) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL15382772 0.87 RAB9A (0.63) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL971875 0.86 NPC1 (1.00) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL22627410 0.86 NPC1 (0.72) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL10655871 0.86 NPC1 (0.72) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL13133694 0.86 NPC1 (0.67) NPC1RAB9AKDM4EMAPTADRA1B
SCHEMBL22627500 0.84 NPC1 (0.68) NPC1RAB9AKDM4EMAPTADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020221380-A1 SELECTIVE LIGANDS OF HUMAN CONSTITUTIVE ANDROSTANE RECEPTOR USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V. V. I. (CZ) 2020-11-05 WO disclosed
EP-3693372-A1 BENZOFURO[3',2':4,5]IMIDAZO[1,2-A]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN ORGANIC LIGHT-EMITTING DEVICES (OLEDS) Samsung Display Co., Ltd. (KR) 2020-08-12 EP disclosed
WO-2020029980-A1 SMAD3 INHIBITORS MOEXA PHARMACEUTICALS LIMITED (CN) 2020-02-13 WO disclosed
WO-2019190184-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2019-10-03 WO disclosed
US-10032994-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-24 US disclosed
US-20180097186-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-05 US disclosed
US-20180076392-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-15 US disclosed
US-9887244-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-02-06 US disclosed
US-9822118-B2 Bicyclic heteroaryl urea, thiourea, guanidine and cyanoguanidine compounds as TrkA kinase inhibitors ARRAY BIOPHARMA INC. (US) 2017-11-21 US disclosed
US-9818960-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-14 US disclosed
US-20070179297-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2007-08-02 US disclosed
US-7244740-B2 Imidazo-pyridine derivatives for use in the treatment of herpes viral infection SMITHKLINE BEECHAM CORPORATION (US) 2007-07-17 US disclosed
US-7238811-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-07-03 US disclosed
US-7238811-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-07-03 US disclosed
US-20070135451-A1 Imidazo[1,2-a]Pyridine Derivatives for Treatment Of Herpes Viral Infections GUDMUNDSSON KRISTJAN S 2007-06-14 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed
US-7186714-B2 Imidazo[1,2-α]pyridine derivatives for the prophylaxis and treatment of herpes viral infections SMITHKLINE BEECHAM CORPORATION (US) 2007-03-06 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US 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 (4 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-20180076392-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME MCM7, CCNB2, CCNE2 NPC1 3377/4885RAB9A 2991/4885KDM4E 4244/4885
US-20180097186-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME C1S, C1R, C9 NPC1 2851/4885RAB9A 4242/4885KDM4E 3724/4885
US-20070135451-A1 Imidazo[1,2-a]Pyridine Derivatives for Treatment Of Herpes Viral Infections IRF3, IFNAR1, IL2 NPC1 1118/4885RAB9A 1481/4885KDM4E 478/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 NPC1 887/4885RAB9A 2189/4885KDM4E 3589/4885

“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.