SCHEMBL7955280

SCHEMBL7955280

CN1C(=O)COc2cc(F)c(N3C(=O)C4=C(CCCC4)C3=O)c(NC(=O)c3ccc4ccccc4c3)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.38
NPC1 O15118 4/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
MCL1 Q07820 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 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
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
TP53 P04637 1/20 0.35
GRM7 Q14831 1/20 0.35
GRM4 Q14833 1/20 0.35
ROCK2 O75116 1/20 0.35

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
SCHEMBL5388347 0.67 CASP3 (0.44) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL532967 0.60 RAB9A (0.57) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL9550835 0.59 RAB9A (0.49) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL24125111 0.58 PTGER3 (0.55) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL6530748 0.57 CYP11B2 (0.34) GRM4
SCHEMBL29209037 0.57 PDE3B (0.35) POLBCYP1A2TP53GRM4HTT
SCHEMBL30336272 0.57 PDE3B (0.35) POLBCYP1A2TP53GRM4HTT
SCHEMBL30336343 0.57 TERT (0.41) POLB
SCHEMBL15786693 0.57 NPC1 (0.69) RAB9ANPC1KMT2AMEN1
SCHEMBL9027440 0.56 GRM1 (0.39) GRM7GRM4

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-6294503-B1 HERBICIDAL COMPOSITIONS CONTAINING HETEROCYCLES ISHIHARA SANGYO KAISHA, LTD. (JP) 2001-09-25 US disclosed