SCHEMBL1820374

SCHEMBL1820374

Pc1cc2ccccc2c(-c2cccc3ccccc23)c1P

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.42
CES1 P23141 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 4/20 0.40
HIF1A Q16665 2/20 0.40
TSHR P16473 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1B1 Q16678 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALPL P05186 1/20 0.39
GAA P10253 1/20 0.39
TYMP P19971 1/20 0.38
DNMT1 P26358 1/20 0.38
SOS1 Q07889 1/20 0.36
ANPEP P15144 1/20 0.36
KCNQ3 O43525 1/20 0.35

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
SCHEMBL6035360 0.82 CYP1A2 (0.44) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL30944688 0.80 DNMT1 (0.47) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL367587 0.80 DNMT1 (0.47) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL338172 0.80 CES1 (0.55) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL7243627 0.76 CES1 (0.52) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL27263879 0.75 ALDH1A1 (0.53) DHFRALDH1A1HSD17B10HIF1ATSHR
SCHEMBL29663473 0.75 GPR84 (0.53) DHFRCES1GPR84ALDH1A1HSD17B10
SCHEMBL28620398 0.73 CES1 (0.49) DHFRCES1GPR84ALDH1A1HSD17B10
Biphenyl SCHEMBL28230506 0.73 CES1 (0.49) CES1GPR84ALDH1A1HSD17B10HIF1A
SCHEMBL29858479 0.73 KDM4E (0.42) DHFRGPR84ALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0433424-B1 IMPROVED ASYMMETRIC CATALYTIC HYDROGENATION OF ALPHA-ARYLPROPENOIC ACIDS MONSANTO CO (US) 1995-05-24 EP claimed
CN-115124460-A Dinaphthalene axis chiral ligand containing coordination unit and preparation method and application thereof 华东理工大学 2022-09-30 CN disclosed
EP-2560959-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-20 EP disclosed
EP-2560960-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-02-26 EP disclosed
US-8524915-B2 Process for the preparation of pyrazole carboxylic acid amides SYNGENTA CROP PROTECTION LLC (US) 2013-09-03 US disclosed
US-8519152-B2 Process for the preparation of pyrazole carboxylic acid amides SYNGENTA CROP PROTECTION LLC (US) 2013-08-27 US disclosed
US-8519151-B2 Process for the preparation of pyrazole carboxylic acid amides SYNGENTA CROP PROTECTION LLC (US) 2013-08-27 US disclosed
EP-2316813-B1 Process for the preparation of amines SYNGENTA PARTICIPATIONS AG (CH) 2013-04-03 EP disclosed
EP-2560958-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES Syngenta Participations AG (CH) 2013-02-27 EP disclosed
EP-2560959-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES Syngenta Participations AG (CH) 2013-02-27 EP disclosed
WO-2011131546-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-10-27 WO disclosed
WO-2011131545-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-10-27 WO disclosed
EP-2316813-A1 Process for the preparation of amines Syngenta Participations AG (CH) 2011-05-04 EP disclosed
EP-2316814-A1 Process for preparation of halogen substituted benzonorbornenes derivatives Syngenta Participations AG (CH) 2011-05-04 EP disclosed
EP-2316809-A1 Process for the preparation of benzonorbornane derivatives Syngenta Participations AG (CH) 2011-05-04 EP disclosed
EP-2316815-A1 Process for preparation of halogen substituted arynes Syngenta Participations AG (CH) 2011-05-04 EP disclosed
US-7781615-B2 Process for the preparation of amines SYNGENTA CROP PROTECTION, INC. (US) 2010-08-24 US disclosed
US-20090221856-A1 PROCESS FOR THE PREPARATION OF AMINES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 US disclosed
EP-1963251-A2 PROCESS FOR THE PREPARATION OF AMINES Syngeta Participations AG (CH) 2008-09-03 EP disclosed
WO-2007068417-A2 PROCESS FOR THE PREPARATION OF AMINES SYNGENTA PARTICIPATIONS AG (CH) 2007-06-21 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 (1 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-20090221856-A1 PROCESS FOR THE PREPARATION OF AMINES HRH3, PAH, C1R DHFR 221/4885CES1 564/4885GPR84 3821/4885

“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.