SCHEMBL14375922

SCHEMBL14375922

Cc1ccc(C(=O)Nc2ccc(C)c(N(C)C)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 12/20 0.62
▸ RAB9A P51151 12/20 0.62
▸ KMT2A Q03164 3/20 0.54
▸ MAPT P10636 7/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ NFKB1 P19838 2/20 0.54
▸ NFKB2 Q00653 2/20 0.54
▸ RELA Q04206 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ HPGD P15428 2/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ KLK7 P49862 1/20 0.54
▸ TP53 P04637 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ P4HTM Q9NXG6 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
SCHEMBL10355528 0.88 KMT2A (0.66) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL10383130 0.79 ALDH1A1 (0.50) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL30828585 0.79 RAB9A (0.54) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL15846834 0.78 NPC1 (0.66) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL31709720 0.78 NPC1 (0.66) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL12310125 0.78 RAB9A (1.00) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL822378 0.78 RAB9A (1.00) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL15214321 0.78 RAB9A (1.00) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL14580374 0.78 RAB9A (1.00) NPC1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL27181403 0.78 RAB9A (1.00) NPC1RAB9AKMT2AMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 — — US disclosed
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 — — US disclosed
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