SCHEMBL20565744

SCHEMBL20565744

CSc1ccc(Cc2cc(C)c(NC(C)=O)cc2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
HPGD P15428 1/20 0.41
TBXA2R P21731 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40
PTGDR Q13258 1/20 0.40
POLB P06746 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
TP53 P04637 1/20 0.38
ACACB O00763 1/20 0.38
MAPT P10636 3/20 0.37
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
AOC3 Q16853 1/20 0.37

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
SCHEMBL28293813 0.86 SMN1; SMN2 (0.45) ALDH1A1HPGDPOLBTP53MAPT
SCHEMBL26228594 0.86 MAPT (0.41) ALDH1A1HPGDPOLBTP53MAPT
SCHEMBL23926291 0.83 KMT2A (0.46) ALDH1A1HPGDPOLBMAPTLMNA
SCHEMBL20562750 0.79 HPGD (0.39) ALDH1A1HPGDPOLBMAPTLMNA
SCHEMBL20565020 0.79 POLB (0.44) ALDH1A1HPGDPOLBLMNACYP3A4
SCHEMBL20563417 0.78 POLB (0.41) ALDH1A1HPGDPOLBLMNACYP3A4
SCHEMBL20563874 0.78 PLK1 (0.45) ALDH1A1HPGDPOLBADORA3MAPT
SCHEMBL30290872 0.77 HPGD (0.53) ALDH1A1HPGDPOLBMAPTLMNA
SCHEMBL28293809 0.77 HSD17B10 (0.46) ALDH1A1HPGDPOLBTP53MAPT
SCHEMBL26228621 0.72 ALDH1A1 (0.58) ALDH1A1SLC6A2SLC6A4SLC6A3TBXA2R

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3625215-B1 FORMIMIDAMIDINE COMPOUNDS USEFUL AGAINST PHYTOPATHOGENIC MICROORGANISMS PI INDUSTRIES LTD (IN) 2023-09-13 EP disclosed
EP-3625215-A1 FORMIMIDAMIDINE COMPOUNDS USEFUL AGAINST PHYTOPATHOGENIC MICROORGANISMS PI Industries Ltd (IN) 2020-03-25 EP disclosed
CN-110770210-A Novel amidine compounds PI工业有限公司 2020-02-07 CN disclosed
CN-109843056-A 4-substituted phenylamine derivatives and their use for protecting crops against undesired phytopathogenic microorganisms 印度商皮埃企业有限公司 2019-06-04 CN disclosed
WO-2018211442-A1 FORMIMIDAMIDINE COMPOUNDS USEFUL AGAINST PHYTOPATHOGENIC MICROORGANISMS PI INDUSTRIES LTD. (IN) 2018-11-22 WO disclosed