SCHEMBL9329455

SCHEMBL9329455

O=C1CCC(CCCc2ccccc2)C(c2ccccc2)N1O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 1/20 0.40
EPHX2 P34913 2/20 0.39
MFN2 O95140 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
BCHE P06276 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
SOAT1 P35610 1/20 0.38

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
SCHEMBL9542534 0.87 EPHX2 (0.39) MEN1KMT2APOLBEPHX2MFN2
SCHEMBL9542527 0.87 EPHX2 (0.39) MEN1KMT2APOLBEPHX2MFN2
SCHEMBL9331285 0.84 MFN2 (0.41) MFN2BCHE
SCHEMBL9877016 0.79 SLC18A3 (0.41)
SCHEMBL9328964 0.79 HSD17B2 (0.40) MEN1KMT2AEPHX2SIGMAR1TP53
SCHEMBL9329407 0.79 HSD17B2 (0.40) MEN1KMT2AEPHX2SIGMAR1TP53
SCHEMBL9329416 0.79 HSD17B2 (0.40) MEN1KMT2AEPHX2SIGMAR1TP53
SCHEMBL9328954 0.79 HSD17B2 (0.40) MEN1KMT2AEPHX2SIGMAR1TP53
SCHEMBL9328959 0.79 HSD17B2 (0.40) MEN1KMT2AEPHX2SIGMAR1TP53
SCHEMBL9876918 0.73 SLC18A2 (0.49)

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-5292884-A Cyclic hydroxamic acids BIOMIDE INVESTMENT LIMITED PARTNERSHIP (US) 1994-03-08 US disclosed