SCHEMBL10352196

SCHEMBL10352196

COc1cc(Cl)c(C)cc1NC(=O)Oc1cc2ccccc2cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
MAPT P10636 5/20 0.57
NPC1 O15118 4/20 0.57
KDM4E B2RXH2 3/20 0.57
MAPK1 P28482 1/20 0.57
NOD2 Q9HC29 1/20 0.57
LMNA P02545 5/20 0.52
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
PPARG P37231 1/20 0.50
ATM Q13315 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
POLB P06746 3/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46

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
SCHEMBL10352019 0.91 KDM4E (0.69) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL10352865 0.88 KDM4E (0.62) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL9621995 0.83 PPARG (0.69) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL29612245 0.82 KMT2A (0.82) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL10423848 0.82 KMT2A (0.82) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL9250804 0.81 KMT2A (0.58) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL9253543 0.81 PPARG (0.65) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL9621593 0.81 MEN1 (0.56) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL9622065 0.80 KMT2A (0.53) MEN1KMT2AMAPTNPC1KDM4E
SCHEMBL10437724 0.80 HTT (0.64) MEN1KMT2AMAPTNPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300390-B1 TRIFLUOROMETHYL-ALKOXY-ANILIN, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE ICE-COLOUR TECHNIQUE HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-29 EP disclosed