SCHEMBL7899044

SCHEMBL7899044

COCCCN1c2c(Cl)ccc(F)c2C(C)C1C1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 1/20 0.38
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
USP30 Q70CQ3 2/20 0.37
SCN9A Q15858 1/20 0.37
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
P2RX7 Q99572 1/20 0.35
BTK Q06187 1/20 0.35
ANO1 Q5XXA6 2/20 0.35
KAT6A Q92794 1/20 0.35
KAT5 Q92993 1/20 0.35
GPR119 Q8TDV5 2/20 0.35
REN P00797 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7900912 0.93 TRPV3 (0.40) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7900415 0.85 USP30 (0.40) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7899660 0.84 USP30 (0.41) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7894370 0.82 SCN9A (0.39) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7902460 0.78 MEN1 (0.40) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7898714 0.76 MMP1 (0.38) ALOX5APFEN1USP30SCN9AGPR119
SCHEMBL7893412 0.75 ALOX5AP (0.39) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7898814 0.73 HTR6 (0.39) TRPV3ALOX5APFEN1USP30SCN9A
SCHEMBL7897488 0.73 USP30 (0.42) USP30SCN9ACNR1CNR2ANO1
SCHEMBL7903239 0.73 USP30 (0.39) ALOX5APFEN1USP30GPR119

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
WO-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 WO disclosed