SCHEMBL13044622

SCHEMBL13044622

Cc1ccc2c(C(=O)C(=O)Nc3ccccc3)c[nH]c2c1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.72
▸ NPC1 O15118 4/20 0.72
▸ CASP3 P42574 1/20 0.72
▸ SENP7 Q9BQF6 1/20 0.72
▸ MEN1 O00255 3/20 0.71
▸ KMT2A Q03164 3/20 0.71
▸ NR4A2 P43354 1/20 0.57
▸ IGF1R P08069 3/20 0.52
▸ MET P08581 1/20 0.51
▸ MAPT P10636 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ THRB P10828 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ KDM1A O60341 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
SCHEMBL13044605 0.92 RAB9A (0.76) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL13042958 0.90 RAB9A (0.72) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL13044620 0.85 RAB9A (0.62) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL13043506 0.84 RAB9A (0.71) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL11921534 0.84 RAB9A (1.00) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL32319858 0.83 RAB9A (1.00) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL11903794 0.83 RAB9A (1.00) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL11921535 0.83 RAB9A (0.74) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL13043017 0.80 RAB9A (0.66) RAB9ANPC1CASP3SENP7MEN1
SCHEMBL13044439 0.80 NPC1 (0.64) RAB9ANPC1CASP3SENP7MEN1

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
WO-2010139982-A1 INDOLE DERIVATIVES FOR THE STIMULATION OF STEM CELL PROLIFERATION THE UNIVERSITY OF SHEFFIELD (GB) 2010-12-09 — — WO disclosed
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