SCHEMBL27921139

SCHEMBL27921139

Cc1c(CO)c2ccccc2n1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP14 P54578 8/20 0.52
▸ HDAC6 Q9UBN7 2/20 0.49
▸ PLA2G2A P14555 1/20 0.49
▸ ABCB1 P08183 2/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ RORC P51449 1/20 0.43
▸ NOTUM Q6P988 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ RUNX1 Q01196 2/20 0.38
▸ CBFB Q13951 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 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
SCHEMBL27939667 0.85 HDAC6 (0.52) USP14HDAC6PLA2G2ARORCMAPT
SCHEMBL27921138 0.84 PLA2G2A (0.49) USP14HDAC6PLA2G2AABCB1PTGS1
SCHEMBL18235058 0.77 USP14 (0.70) USP14RORC
SCHEMBL28785169 0.77 ABCB1 (0.58) USP14HDAC6PLA2G2AABCB1PTGS1
SCHEMBL3969842 0.75 GPR3 (0.56) GAAMAPTMEN1KMT2AKDM4E
SCHEMBL19298011 0.74 USP14 (0.70) USP14RORC
SCHEMBL12546471 0.74 KDM4E (0.67) USP14GAAMAPTMEN1NPC1
SCHEMBL31045466 0.74 KDM4E (0.67) USP14GAAMAPTMEN1NPC1
SCHEMBL18235059 0.73 NPSR1 (0.50) USP14RORCMAPTMEN1KMT2A
SCHEMBL18235061 0.72 USP14 (0.66) USP14RORC

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
CN-101360422-B Oncogenic Ras-specific cytotoxic compound and methods of usethereof UNIV TEXAS 2013-10-23 — — CN claimed
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