SCHEMBL19917673

SCHEMBL19917673

CC(C)N(CC(=O)NCc1ccc(F)c(-c2ccc(C(F)(F)F)cc2)c1)Sc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.42
▸ TRPA1 O75762 3/20 0.41
▸ LMNA P02545 1/20 0.40
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRL1 P41146 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PPARA Q07869 1/20 0.37
▸ PTGER1 P34995 1/20 0.37
▸ PTGES O14684 2/20 0.37

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
SCHEMBL19917692 0.90 CASR (0.57) CASRTRPA1MEN1KMT2APPARA
SCHEMBL19917766 0.88 LMNA (0.44) CASRTRPA1LMNAMEN1KMT2A
SCHEMBL19917750 0.87 TRPA1 (0.53) TRPA1LMNAMEN1KMT2AHPGD
SCHEMBL19917689 0.86 LMNA (0.41) CASRTRPA1LMNAOPRM1OPRL1
SCHEMBL19917733 0.86 TRPA1 (0.55) CASRTRPA1LMNAMEN1KMT2A
SCHEMBL19917670 0.85 TRPA1 (0.44) TRPA1LMNAOPRM1OPRL1HPGD
SCHEMBL19917756 0.85 TRPA1 (0.46) TRPA1LMNAPTGER1
SCHEMBL19917691 0.83 KDM1A (0.45) TRPA1LMNAMEN1KMT2AOPRM1
SCHEMBL16894112 0.82 TRPA1 (0.56) TRPA1PTGER1
SCHEMBL19917716 0.81 TRPA1 (0.41) CASRTRPA1LMNA

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
EP-2900642-B1 SUBSTITUTED SULFONAMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2018-02-28 — — EP disclosed
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