SCHEMBL382818

SCHEMBL382818

Brc1ccc(-n2cnnn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.64
MAPT P10636 2/20 0.64
F2 P00734 1/20 0.64
KCNJ1 P48048 3/20 0.60
RAB9A P51151 2/20 0.59
ALDH1A1 P00352 3/20 0.58
LMNA P02545 1/20 0.58
HTT P42858 1/20 0.58
ATF4 P18848 1/20 0.54
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.47
BLM P54132 1/20 0.47
TDP1 Q9NUW8 1/20 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
SCHEMBL12615985 0.89 NOTUM (0.78) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL4582384 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL11711879 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL8485436 0.78 KCNJ1 (0.66) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL11831417 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL1163779 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL311636 0.78 MAPT (1.00) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL82595 0.78 MAPT (0.69) NOTUMMAPTF2KCNJ1ALDH1A1
SCHEMBL17993966 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1RAB9A
SCHEMBL11118984 0.78 NOTUM (0.64) NOTUMMAPTF2KCNJ1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4665733-A1 AMINO-SUBSTITUTED PYRROLOTRIAZINE DERIVATIVES AS INHIBITORS OF SGK1 Bristol-Myers Squibb Company (US) 2025-12-24 EP disclosed
WO-2024173323-A1 AMINO-SUBSTITUTED PYRROLOTRIAZINE DERIVATIVES AS INHIBITORS OF SGK1 BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-22 WO disclosed
CN-109153663-A Triazolones and Tetrazolones as ROCK Inhibitors 百时美施贵宝公司 2019-01-04 CN disclosed
EP-2888008-B1 NOVEL AZABENZIMIDAZOLE TETRAHYDROFURAN DERIVATIVES MERCK SHARP & DOHME (US) 2018-12-26 EP disclosed
CN-103958495-B The compound of conditioning agent as GPR-119 理森制药股份公司 2018-06-22 CN disclosed
US-9868733-B2 Azabenzimidazole tetrahydrofuran derivatives MERCK SHARP & DOHME CORP. (US) 2018-01-16 US disclosed
US-20180009807-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME LLC 2018-01-11 US disclosed
US-20170342089-A1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2017-11-30 US disclosed
US-9777018-B2 Compounds as modulators of GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2017-10-03 US disclosed
EP-2718279-B1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2016-08-10 EP disclosed
CN-102898400-A GPR119 agonist and application thereof BEIJING HANMEI PHARMACEUTICAL CO LTD 2013-01-30 CN disclosed
WO-2012170867-A1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 RHIZEN PHARMACEUTICALS SA (CH) 2012-12-13 WO disclosed
WO-2012103806-A1 BICYCLIC HETEROARYL COMPOUNDS AS GPR119 RECEPTOR AGONISTS CENTAURUS BIOPHARMA CO., LTD. (CN) 2012-08-09 WO disclosed
WO-2012103806-A1 BICYCLIC HETEROARYL COMPOUNDS AS GPR119 RECEPTOR AGONISTS CENTAURUS BIOPHARMA CO., LTD. (CN) 2012-08-09 WO disclosed
CN-102617548-A Bicycloheteroaryl compounds as GPR Receptor stimulant, compositions and application thereof BEIJING CENTAURUS BIOPHARMA TECHNOLOGY CO LTD 2012-08-01 CN disclosed
EP-2408742-A1 ANTHELMINTIC AGENTS AND THEIR USE Intervet International B.V. (NL) 2012-01-25 EP disclosed
US-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2011-12-29 US disclosed
WO-2010115688-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2010-10-14 WO disclosed
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed
WO-2006018682-A2 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2006-02-23 WO 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 (3 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-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE ACHE, ABCB11, MPO NOTUM 157/4885MAPT 1648/4885F2 2579/4885
US-20180009807-A1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL KCNJ11, KCNJ1, KCNJ2 NOTUM 4305/4885MAPT 4320/4885F2 4683/4885
US-20170342089-A1 NOVEL COMPOUNDS AS MODULATORS OF GPR-119 GPR119, GPR39, GPBAR1 NOTUM 4629/4885MAPT 3977/4885F2 4749/4885

“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.