SCHEMBL1422471

SCHEMBL1422471

CCCCCCCCCCCCCCCCCCc1c(C(=O)C(=O)c2ccccc2)cc(N)c(C)c1C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.47
CES1 P23141 6/20 0.47
NAAA Q02083 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
KAT8 Q9H7Z6 2/20 0.37
PPARA Q07869 1/20 0.37
RARB P10826 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
SCHEMBL4493600 0.80 CES2 (0.47) CES2CES1NAAAKDM4EALDH1A1
SCHEMBL4489142 0.80 CES2 (0.47) CES2CES1NAAAKDM4EALDH1A1
Ammonia Solution, Strong SCHEMBL1422472 0.79 CES2 (0.49) CES2CES1NAAATHRATHRB
Hydrochloric Acid SCHEMBL6848392 0.79 CES2 (0.46) CES2CES1NAAAKDM4EALDH1A1
Bromide SCHEMBL11146660 0.79 CES2 (0.46) CES2CES1NAAAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8642216 0.79 CES2 (0.46) CES2CES1NAAAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8607225 0.76 CES2 (0.47) CES2CES1KDM4EALDH1A1POLB
SCHEMBL27578934 0.75 CES2 (0.50) CES2CES1NAAAKAT8PPARA
SCHEMBL1963286 0.75 MAPT (0.45) CES2CES1NAAAKDM4EALDH1A1
SCHEMBL29067602 0.74 CES2 (0.45) CES2CES1NAAAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1925590-B1 RESIN BASES WITH A LIGHT-RESISTANT TITANIC ACID COATING FILM OTSUKA CHEMICAL CO LTD (JP) 2011-03-23 EP disclosed
US-20090246555-A1 Light-resistant titanic acid coating film and resin bases with the coating film OTSUKA CHEMICAL CO., LTD. (JP) 2009-10-01 US disclosed
EP-1925590-A1 LIGHT-RESISTANT TITANIC ACID COATING FILM AND RESIN BASES WITH THE COATING FILM Otsuka Chemical Co., Ltd. (JP) 2008-05-28 EP disclosed