SCHEMBL10061571

SCHEMBL10061571

COc1cccc(NC(=O)CC(=O)Nc2cccc(CO)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.68
RAB9A P51151 4/20 0.65
NPC1 O15118 4/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
HPGD P15428 3/20 0.60
ALDH1A1 P00352 1/20 0.60
SMN1; SMN2 Q16637 4/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
MTNR1B P49286 2/20 0.58
LMNA P02545 1/20 0.58
TP53 P04637 2/20 0.56
GAA P10253 1/20 0.56
ALOX15 P16050 1/20 0.56
MAPT P10636 1/20 0.56
MTNR1A P48039 1/20 0.56
TSHR P16473 1/20 0.55

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
SCHEMBL29200389 0.90 TP53 (0.68) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL30802673 0.90 TP53 (0.68) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL5142657 0.89 NPC1 (0.75) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL10027961 0.89 RAB9A (0.67) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL14817534 0.84 MEN1 (0.68) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL2856692 0.83 HPGD (0.68) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL16896918 0.82 NPC1 (0.74) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL3470179 0.82 MEN1 (0.69) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL2605765 0.81 HPGD (0.66) USP2RAB9ANPC1MEN1KMT2A
SCHEMBL27487690 0.81 USP2 (1.00) USP2RAB9ANPC1MEN1KMT2A

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-20120021357-A1 POSITIVE-TYPE PHOTOSENSITIVE INSULATING RESIN COMPOSITION, AND PATTERN FORMING METHOD USING SAME NEC CORPORATION (JP) 2012-01-26 US disclosed