SCHEMBL10489680

SCHEMBL10489680

Cc1noc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc12

nearest known ligand 0.52

Predicted protein targets (top 19)

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 0.40
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ EGFR P00533 1/20 0.37
▸ ERBB2 P04626 1/20 0.37
▸ ERBB3 P21860 1/20 0.37
▸ ERBB4 Q15303 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ ATM Q13315 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
SCHEMBL4327000 0.91 FFAR1 (0.44) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10368379 0.86 FFAR1 (0.46) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10489722 0.84 LMNA (0.53) FFAR1MEN1TTRKMT2ATDP1
SCHEMBL13202676 0.79 EPHX2 (0.58) KCNH2EPHX2L3MBTL1
SCHEMBL10482181 0.78 HTR2A (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11095176 0.76 FFAR1 (0.65) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL15384989 0.75 HTR2A (0.59) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10489729 0.74 RAB9A (0.42) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL11014355 0.74 FFAR1 (0.48) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10615136 0.72 FFAR1 (0.55) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 — — US claimed
US-4888041-A POST EMERGENCE HERBICIDES THE DOW CHEMICAL COMPANY (US) 1989-12-19 — — US disclosed
US-4888041-A POST EMERGENCE HERBICIDES THE DOW CHEMICAL COMPANY (US) 1989-12-19 — — US disclosed
US-4571255-A Subsituted phenoxybenzisoxazole herbicides PPG INDUSTRIES, INC. (US) 1986-02-18 — — US disclosed
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