SCHEMBL8235458

SCHEMBL8235458

Cc1cc(C(=O)Nc2ccc(CN)cc2)cc(Cl)c1OCCN

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 12/20 0.65
▸ TAS1R3 Q7RTX0 1/20 0.48
▸ TAS1R1 Q7RTX1 1/20 0.48
▸ TAS1R2 Q8TE23 1/20 0.48
▸ KLKB1 P03952 3/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ PLG P00747 2/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ KLK6 Q92876 1/20 0.44
▸ PLAT P00750 1/20 0.43
▸ PRSS1 P07477 1/20 0.43

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
SCHEMBL8230026 0.92 PLAU (0.77) PLAUTAS1R3TAS1R1TAS1R2KLKB1
SCHEMBL8235456 0.84 PLAU (0.47) PLAUTAS1R3TAS1R1TAS1R2KLKB1
SCHEMBL8230030 0.83 PLAU (0.53) PLAUTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL8239843 0.83 PLAU (0.70) PLAUTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL8238849 0.82 PLAU (0.88) PLAUKLKB1MEN1NPC1RAB9A
SCHEMBL8235966 0.82 PLAU (0.59) PLAUTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL8237387 0.82 PLAU (0.69) PLAUTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL8237186 0.81 PLAU (0.67) PLAUTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL8235965 0.80 PLAU (0.54) PLAU
SCHEMBL8235964 0.80 PLAU (0.85) PLAUTAS1R3TAS1R1TAS1R2KLKB1

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-2007072041-A1 THERAPEUTIC COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2007-06-28 — — WO disclosed
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