SCHEMBL8696547

SCHEMBL8696547

CCC/C=C1\c2cc(Cl)ccc2NC(=O)C1(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.42
CES1 P23141 1/20 0.42
IDO1 P14902 3/20 0.40
PGR P06401 3/20 0.40
TDO2 P48775 2/20 0.40
MAPT P10636 1/20 0.39
MGAT1 P26572 1/20 0.38
MGAT3 Q09327 1/20 0.38
MGAT2 Q10469 1/20 0.38
MDM2 Q00987 1/20 0.38
LRRK2 Q5S007 3/20 0.37
MAOB P27338 1/20 0.37
CBX7 O95931 1/20 0.37
CDYL2 Q8N8U2 1/20 0.37
CDYL Q9Y232 1/20 0.37
CDY1; CDY1B Q9Y6F8 1/20 0.37
RET P07949 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36

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
SCHEMBL8693444 1.00 TGM2 (0.42) TGM2CES1IDO1PGRTDO2
SCHEMBL8697033 1.00 TGM2 (0.42) TGM2CES1IDO1PGRTDO2
SCHEMBL8694315 0.84 CHRM1 (0.46) TGM2CES1IDO1PGRTDO2
SCHEMBL7426938 0.75 MAPT (0.55) TGM2CES1IDO1PGRTDO2
SCHEMBL7478070 0.73 NSD2 (0.42) TGM2CES1MAPT
SCHEMBL7483462 0.73 NSD2 (0.42) TGM2CES1MAPT
SCHEMBL7472238 0.73 NSD2 (0.42) TGM2CES1MAPT
SCHEMBL8880980 0.70 MDM2 (0.40) TGM2CES1IDO1PGRTDO2
SCHEMBL8880758 0.69 MAOB (0.41) TGM2CES1IDO1PGRTDO2
SCHEMBL8880752 0.69 MAOB (0.41) TGM2CES1IDO1PGRTDO2

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
US-5798365-A VIRICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-25 US disclosed