SCHEMBL13996533

SCHEMBL13996533

CCC(C)(C)Nc1cccc(NC(C)=O)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.61
▸ POLB P06746 1/20 0.61
▸ NR4A1 P22736 1/20 0.61
▸ MAPT P10636 2/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ TSHR P16473 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ NQO2 P16083 1/20 0.48
▸ NAPRT Q6XQN6 1/20 0.47

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
SCHEMBL10294089 0.86 RAB9A (0.64) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL14781004 0.84 AR (0.42) RAB9APOLBNR4A1MAPTMEN1
SCHEMBL1901172 0.80 ALDH1A1 (0.76) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL19286578 0.79 POLB (0.37) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL11654042 0.78 MEN1 (0.55) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL16152763 0.78 AR (0.38) RAB9APOLBNR4A1MAPTMEN1
SCHEMBL12655113 0.77 POLB (0.57) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL28829520 0.77 L3MBTL1 (0.55) RAB9APOLBNR4A1MAPTL3MBTL1
SCHEMBL13996668 0.77 NPC1 (0.50) RAB9APOLBMAPTMEN1KMT2A
SCHEMBL11653163 0.76 L3MBTL1 (0.54) RAB9APOLBNR4A1MAPTL3MBTL1

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-7465726-B2 Substituted pyrrolo[2.3-B]pyridines OSI PHARMACEUTICALS, INC. (US) 2008-12-16 — — US disclosed
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