SCHEMBL1065124

SCHEMBL1065124

CCOC(=O)c1cnn(-c2ccccc2)c1C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.75
HPGD P15428 3/20 0.75
SMN1; SMN2 Q16637 5/20 0.70
MAPK1 P28482 1/20 0.66
RAB9A P51151 5/20 0.64
NPC1 O15118 2/20 0.64
MAPT P10636 2/20 0.64
NFKB1 P19838 2/20 0.64
NFKB2 Q00653 2/20 0.64
RELA Q04206 2/20 0.64
HTT P42858 2/20 0.61
LMNA P02545 1/20 0.60
TP53 P04637 1/20 0.58
ALOX12 P18054 1/20 0.58
PDE4D Q08499 1/20 0.58
TSHR P16473 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
KDM4E B2RXH2 1/20 0.58
SLC9A1 P19634 1/20 0.57
SLC9A2 Q9UBY0 1/20 0.57

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
SCHEMBL1062661 0.87 ALDH1A1 (0.64) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL3323394 0.87 ALDH1A1 (0.58) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL798337 0.87 ALDH1A1 (0.73) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL15167569 0.87 ALDH1A1 (0.61) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL19103511 0.86 HTT (0.61) ALDH1A1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL13887595 0.86 NR4A3 (0.72) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL3057553 0.86 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2RAB9AHTT
SCHEMBL3264275 0.86 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL5069717 0.86 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2MAPK1RAB9A
SCHEMBL1143334 0.86 ALDH1A1 (1.00) ALDH1A1HPGDSMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025105857-A1 HETEROARYL-DERIVATIVE COMPOUND AND USE THEREOF (주)신테카바이오 2025-05-22 WO disclosed
CN-114181150-A Pyrazole amide derivative, preparation method and application thereof 沈阳万菱生物技术有限公司 2022-03-15 CN disclosed
EP-3087058-B1 PROCESS FOR THE REGIOSELECTIVE SYNTHESIS OF PYRAZOLES ISAGRO SPA (IT) 2017-09-06 EP disclosed
US-9676726-B2 Process for the regioselective synthesis of pyrazoles ISAGRO S.P.A. (IT) 2017-06-13 US disclosed
US-9676726-B2 Process for the regioselective synthesis of pyrazoles ISAGRO S.P.A. (IT) 2017-06-13 US disclosed
US-20160318874-A1 PROCESS FOR THE REGIOSELECTIVE SYNTHESIS OF PYRAZOLES FMC IP TECHNOLOGY GMBH (CH) 2016-11-03 US disclosed
US-20160318874-A1 PROCESS FOR THE REGIOSELECTIVE SYNTHESIS OF PYRAZOLES FMC IP TECHNOLOGY GMBH (CH) 2016-11-03 US disclosed
US-20160295864-A1 ETHEREAL OXYGEN ATOM-CONTAINING PERFLUOROALKYL GROUP-SUBSTITUTED PYRAZOLE RING COMPOUND AND METHOD FOR ITS PRODUCTION ASAHI GLASS COMPANY, LIMITED (JP) 2016-10-13 US disclosed
EP-2308838-B1 NITROGEN-CONTAINING AROMATIC HETEROCYCLYL COMPOUND DAIICHI SANKYO CO LTD (JP) 2016-02-17 EP disclosed
US-9150563-B2 Nitrogen-containing aromatic heterocyclyl compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-10-06 US disclosed
EP-1594438-A2 USE OF AN INHIBITOR OF 15-HYDROXYPROSTAGLANDIN DEHYDROGENASE IN ORDER TO STIMULATE PIGMENTATION OF THE SKIN OR SKIN APPENDAGES L'OREAL (FR) 2005-11-16 EP disclosed
US-20050239797-A1 Isoquinoline and quinazoline derivatives having a combined 5HT1A, 5HT1B, and 5HT1D receptor activity SMITHKLINE BEECHAM, PLC 2005-10-27 US disclosed
EP-1565150-A1 COMPOSITION FOR HAIR CARE OR EYELASHES CONTAINING A PYRAZOL-CARBOXAMIDE, ITS USE FOR STIMULATING HAIR AND EYELASH GROWTH AND/OR FOR PREVENTING LOSS THEREOF L'OREAL (FR) 2005-08-24 EP disclosed
WO-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed
EP-1228043-B1 ISOQUINOLINE AND QUINAZOLINE DEIVATIVES HAVING A COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2005-01-12 EP disclosed
US-20040235831-A1 Composition for caring for the hair or the eyelashes, containing a pyrazolecarboxamide compound, use thereof for stimulating the growth of the hair and the eyelashes and/or for reducing their loss SOCIETE L'OREAL, S.A. (FR) 2004-11-25 US disclosed
WO-2004073594-A2 USE OF AN INHIBITOR OF 15-HYDROXYPROSTAGLANDIN DEHYDROGENASE IN ORDER TO STIMULATE PIGMENTATION OF THE SKIN OR SKIN APPENDAGES L'OREAL (FR) 2004-09-02 WO disclosed
WO-2004047776-A1 COMPOSITION FOR HAIR CARE OR EYELASHES CONTAINING A PYRAZOL-CARBOXAMIDE, ITS USE FOR STIMULATING HAIR AND EYELASH GROWTH AND/OR FOR PREVENTING LOSS THEREOF L'OREAL (FR) 2004-06-10 WO disclosed
EP-1228043-A1 ISOQUINOLINE AND QUINAZOLINE DEIVATIVES HAVING A COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2002-08-07 EP disclosed
WO-2001032626-A1 ISOQUINOLINE AND QUINAZOLINE DERIVATIVES HAVING A COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ACTIVITY SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-10 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 (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-20160318874-A1 PROCESS FOR THE REGIOSELECTIVE SYNTHESIS OF PYRAZOLES CYP4F11, CYP2F1, CYP3A4 ALDH1A1 273/4885HPGD 169/4885SMN1; SMN2 4801/4885
US-20160295864-A1 ETHEREAL OXYGEN ATOM-CONTAINING PERFLUOROALKYL GROUP-SUBSTITUTED PYRAZOLE RING COMPOUND AND METHOD FOR ITS PRODUCTION CYP2F1, CYP2E1, CYP2C19 ALDH1A1 738/4885HPGD 1194/4885SMN1; SMN2 4279/4885
US-20050239797-A1 Isoquinoline and quinazoline derivatives having a combined 5HT1A, 5HT1B, and 5HT1D receptor activity HTR1B, HTR1A, HTR1D ALDH1A1 489/4885HPGD 1763/4885SMN1; SMN2 1271/4885
US-20040235831-A1 Composition for caring for the hair or the eyelashes, containing a pyrazolecarboxamide compound, use thereof for stimulating the growth of the hair and the eyelashes and/or for reducing their loss BCOR, HCRTR1, RCOR1 ALDH1A1 3475/4885HPGD 3731/4885SMN1; SMN2 4065/4885

“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.