SCHEMBL4327000

SCHEMBL4327000

Cc1noc2cc(Oc3ccc(C(F)(F)F)cc3Cl)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ TTR P02766 1/20 0.43
▸ PPOX P50336 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HTR2A P28223 6/20 0.42
▸ SLC6A4 P31645 6/20 0.42
▸ KCNH2 Q12809 6/20 0.42
▸ EPHX2 P34913 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TEAD1 P28347 1/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL10489680 0.91 FFAR1 (0.44) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL12646428 0.79 EPHX2 (0.56) KCNH2EPHX2MAPTLMNA
SCHEMBL10368379 0.79 FFAR1 (0.46) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10482181 0.78 HTR2A (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11095176 0.76 FFAR1 (0.65) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL15384989 0.75 HTR2A (0.59) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11014355 0.74 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10489722 0.74 LMNA (0.53) FFAR1MEN1TTRKMT2ATDP1
SCHEMBL10609119 0.73 FFAR1 (0.46) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL4823721 0.73 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2039685-A2 Heterobicyclic compounds as P38 inhibitors Array Biopharma, Inc. (US) 2009-03-25 — — EP claimed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 — — US claimed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 — — US disclosed
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