SCHEMBL11676680

SCHEMBL11676680

CCN(c1ccccc1)C(C)OC(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ GAA P10253 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ UTS2R Q9UKP6 4/20 0.49
▸ ALDH1A1 P00352 1/20 0.47
▸ KLK7 P49862 3/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP19A1 P11511 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ NPY5R Q15761 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
SCHEMBL10409304 0.91 KMT2A (0.50) MAPTKMT2AMEN1HTTSMN1; SMN2
SCHEMBL11677282 0.87 HPGD (0.54) MAPTKMT2AMEN1GAAHTT
SCHEMBL11675558 0.87 KMT2A (0.53) MAPTKMT2AMEN1HTTALDH1A1
SCHEMBL11676807 0.87 MEN1 (0.61) MAPTKMT2AMEN1HTTSMN1; SMN2
SCHEMBL11676725 0.81 KMT2A (0.44) MAPTKMT2AMEN1HTTSMN1; SMN2
SCHEMBL11676569 0.81 UTS2R (0.46) KMT2AMEN1UTS2RALDH1A1L3MBTL1
SCHEMBL11660003 0.81 THRB (0.45) MAPTKMT2AMEN1HTTALDH1A1
SCHEMBL11674587 0.79 MTNR1B (0.52) GAAHTTSMN1; SMN2UTS2RALDH1A1
SCHEMBL11671034 0.79 LMNA (0.45) MAPTKMT2AMEN1GAAHTT
SCHEMBL11680345 0.79 ALDH1A1 (0.48) MAPTKMT2AMEN1HTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4051117-A Triazole-azo-phenyl cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 — — US disclosed
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