SCHEMBL14015616

SCHEMBL14015616

BC(=O)N1CCc2[nH]c3ccc(C(F)(F)F)cc3c2C1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 8/20 0.66
▸ CTSK P43235 1/20 0.57
▸ BAZ2B Q9UIF8 9/20 0.57
▸ TRPV1 Q8NER1 1/20 0.53
▸ LMNA P02545 1/20 0.50
▸ PABPC1 P11940 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL14015613 0.84 BAZ2B (0.77) CFTRCTSKBAZ2BSMN1; SMN2
SCHEMBL5107538 0.83 CFTR (0.61) CFTRCTSKBAZ2BTRPV1LMNA
SCHEMBL23828222 0.80 CFTR (1.00) CFTR
SCHEMBL31020945 0.80 CFTR (1.00) CFTR
SCHEMBL5376181 0.80 TRPV1 (0.66) CFTRCTSKTRPV1
SCHEMBL2189728 0.79 L3MBTL1 (0.65) CFTR
SCHEMBL14015615 0.78 MAPT (0.75) CFTRBAZ2BLMNAATM
SCHEMBL31117487 0.76 TRPV1 (0.62) CFTRTRPV1
SCHEMBL31020940 0.76 CFTR (0.61) CFTRBAZ2BLMNAPABPC1ATM
SCHEMBL23828211 0.76 CFTR (0.61) CFTRBAZ2BLMNAPABPC1ATM

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-7449476-B2 Tetrahydrocarboline antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-11 — — US disclosed
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