SCHEMBL7252164

SCHEMBL7252164

CC(=NO)c1ccc(Oc2cc[c]cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 1/20 0.49
▸ HPGD P15428 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ PPARG P37231 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GFER P55789 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ CA9 Q16790 3/20 0.37
▸ BRAF P15056 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PARP10 Q53GL7 2/20 0.35
▸ PARP15 Q460N3 1/20 0.35
▸ PARP14 Q460N5 1/20 0.35
▸ PARP16 Q8N5Y8 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
SCHEMBL7252160 1.00 FURIN (0.49) FURINHPGDMAPTRAB9APPARG
SCHEMBL6346576 0.82 CA9 (0.40) FURINHPGDMAPTRAB9AKMT2A
SCHEMBL6346578 0.82 CA9 (0.40) FURINHPGDMAPTRAB9AKMT2A
SCHEMBL9411079 0.82 CA9 (0.40) FURINHPGDMAPTRAB9AKMT2A
SCHEMBL8438349 0.81 FURIN (0.52) FURINHPGDMAPTRAB9APPARG
SCHEMBL16255397 0.79 FURIN (0.50) FURINHPGDMAPTRAB9AKMT2A
SCHEMBL2545564 0.75 GAA (0.54) FURINHPGDMAPTRAB9APPARG
SCHEMBL754261 0.75 GAA (0.54) FURINHPGDMAPTRAB9APPARG
SCHEMBL12360950 0.74 CA9 (0.52) FURINHPGDMAPTRAB9AKMT2A
SCHEMBL14298196 0.74 CA9 (0.52) FURINHPGDMAPTRAB9AKMT2A

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-6610731-B2 Antiinflammatory BRISTOL-MYERS SQUIBB COMPANY 2003-08-26 — — US disclosed
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