SCHEMBL4842310

SCHEMBL4842310

Nc1ccccc1CNC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.58
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 4/20 0.58
CYP2D6 P10635 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 1/20 0.52
RCE1 Q9Y256 1/20 0.50
FDPS P14324 1/20 0.49
HTT P42858 1/20 0.47
CYP3A4 P08684 2/20 0.47
NSD2 O96028 2/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL15939820 0.86 NPC1 (0.60) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL29935885 0.85 CYP1A2 (0.55) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL9156343 0.85 CYP1A2 (0.55) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL10604929 0.85 HPGD (0.67) HPGDALDH1A1KDM4ECYP2D6RCE1
SCHEMBL28029765 0.84 HPGD (0.54) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL5929981 0.83 HPGD (0.50) HPGDALDH1A1KDM4ECYP2D6CYP2C19
Hydrochloric Acid SCHEMBL11157053 0.83 CYP1A2 (0.53) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL10416108 0.82 HPGD (0.57) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL4598193 0.81 MTNR1A (0.46) HPGDALDH1A1KDM4ECYP2D6CYP2C19
SCHEMBL29508722 0.81 HPGD (0.79) HPGDALDH1A1KDM4ECYP2D6RCE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230391730-A1 INHIBITORS OF THE BROMODOMAIN PHD FINGER TRANSCRIPTION FACTOR (BPTF) AS ANTI-CANCER AGENTS REGENTS OF THE UNIVERSITY OF MINNESOTA 2023-12-07 US disclosed
US-20230137893-A1 PYRROLO[2,3-b]PYRIDINE-3-CARBOXAMIDE COMPOSITIONS AND METHODS FOR AMELIORATING HEARING LOSS THE ROCKEFELLER UNIVERSITY (US) 2023-05-04 US disclosed
WO-2020255038-A1 COMBINATION OF HEPATITIS B VIRUS (HBV) VACCINES AND PYRIDOPYRIMIDINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2020-12-24 WO disclosed
US-10590112-B2 Dihydropyrimidinyl benzazepine carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2020-03-17 US disclosed
EP-3143021-B1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER (US) 2019-06-12 EP disclosed
US-20190135788-A1 DIHYDROPYRIMIDINYL BENZAZEPINE CARBOXAMIDE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2019-05-09 US disclosed
US-10022376-B2 Pyrazolopyridines and pyrazolopyrimidines PFIZER INC. (US) 2018-07-17 US disclosed
EP-3143021-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES Pfizer Inc (US) 2017-03-22 EP disclosed
US-20170071946-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER INC. (US) 2017-03-16 US disclosed
US-20160362408-A1 ARYL- AND HETARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE-3-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-15 US disclosed
US-20150329542-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER INC. 2015-11-19 US disclosed
WO-2015173683-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER INC. (US) 2015-11-19 WO disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 US disclosed
US-20060223826-A1 Indole derivatives as somatostatin agonists or antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED INTELLECTUAL PROPERTY DEPARTMENT (JP) 2006-10-05 US disclosed
US-20060173034-A1 Novel 4-anilinoquinoline-3-carboxamides ASTRAZENECA AB (SE) 2006-08-03 US disclosed
US-7037925-B2 4-anilinoquinoline-3-carboxamides ASTRAZENECA AB (SE) 2006-05-02 US disclosed
US-20040248923-A1 Novel 4-anilinoquinoline-3-carboxamides ASTRAZENECA AB (SE) 2004-12-09 US disclosed
EP-1387830-A1 NOVEL 4-ANILINOQUINOLINE-3-CARBOXAMIDES AstraZeneca AB (SE) 2004-02-11 EP disclosed
WO-2002092571-A1 NOVEL 4-ANILINOQUINOLINE-3-CARBOXAMIDES ASTRAZENECA AB (SE) 2002-11-21 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 (12 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-20060223826-A1 Indole derivatives as somatostatin agonists or antagonists SSTR1, SSTR3, NPY1R HPGD 2131/4885ALDH1A1 2632/4885KDM4E 2069/4885
US-20160362408-A1 ARYL- AND HETARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE-3-CARBOXAMIDES AND USE THEREOF AADAC, PAH, CYP2C8 HPGD 167/4885ALDH1A1 654/4885KDM4E 2730/4885
US-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 HPGD 3316/4885ALDH1A1 1819/4885KDM4E 1574/4885
US-20190135788-A1 DIHYDROPYRIMIDINYL BENZAZEPINE CARBOXAMIDE COMPOUNDS TLR8, TLR1, TLR5 HPGD 3296/4885ALDH1A1 1894/4885KDM4E 1129/4885
US-10590112-B2 Dihydropyrimidinyl benzazepine carboxamide compounds TLR8, TLR1, TLR5 HPGD 3296/4885ALDH1A1 1894/4885KDM4E 1129/4885
US-10022376-B2 Pyrazolopyridines and pyrazolopyrimidines CBR3, HRH4, REN HPGD 1740/4885ALDH1A1 2993/4885KDM4E 4113/4885
US-20150329542-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES HRH2, HRH4, HRH1 HPGD 2891/4885ALDH1A1 3745/4885KDM4E 4660/4885
US-20040248923-A1 Novel 4-anilinoquinoline-3-carboxamides JAK3, JAK2, JAK1 HPGD 3742/4885ALDH1A1 2836/4885KDM4E 488/4885
US-20230391730-A1 INHIBITORS OF THE BROMODOMAIN PHD FINGER TRANSCRIPTION FACTOR (BPTF) AS ANTI-CANCER AGENTS BPTF, BRPF3, PHF6 HPGD 2969/4885ALDH1A1 2997/4885KDM4E 709/4885
US-20230137893-A1 PYRROLO[2,3-b]PYRIDINE-3-CARBOXAMIDE COMPOSITIONS AND METHODS FOR AMELIORATING HEARING LOSS LATS2, LATS1, YAP1 HPGD 2492/4885ALDH1A1 3775/4885KDM4E 1083/4885
US-20060173034-A1 Novel 4-anilinoquinoline-3-carboxamides JAK3, JAK2, JAK1 HPGD 4243/4885ALDH1A1 3672/4885KDM4E 455/4885
US-20170071946-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES HRH2, HRH4, HRH1 HPGD 2891/4885ALDH1A1 3745/4885KDM4E 4660/4885

“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.