SCHEMBL13665084

SCHEMBL13665084

Cc1ccc(NC(=O)c2oc3ccc(C(=O)N4CCCC4)cc3c2NC(=O)[C@H]2CC[C@H](C(=O)N(C)C)CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ABL1 P00519 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ TYK2 P29597 1/20 0.37
▸ GLA P06280 1/20 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
SCHEMBL13665085 0.94 ABL1 (0.46) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL13664971 0.92 F10 (0.42) GRM5
SCHEMBL13665080 0.89 NPC1 (0.46) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL13665082 0.89 NPC1 (0.46) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL13665078 0.88 NPC1 (0.49) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL13665067 0.87 NPC1 (0.41) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL4318062 0.86 F10 (0.45) ABL1GRM5
SCHEMBL4318072 0.86 F10 (0.45) ABL1GRM5
SCHEMBL13665087 0.84 NPC1 (0.42) NPC1RAB9AKMT2ACASP3SENP7
SCHEMBL13665094 0.84 KMT2A (0.42) NPC1RAB9AKMT2ACASP3SENP7

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-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
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