SCHEMBL13928754

SCHEMBL13928754

Cc1cc(OC(C)C(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c(C)c(C)c1N

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ POLB P06746 2/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ HPGD P15428 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPK10 P53779 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ KCNA5 P22460 1/20 0.44

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
SCHEMBL13928766 0.85 HPGD (0.43) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL4211853 0.85 SMN1; SMN2 (0.54) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL4208589 0.85 HPGD (0.45) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL13928715 0.84 DRD4 (0.43) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL13928752 0.83 SMN1; SMN2 (0.51) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL13928749 0.83 CCR5 (0.43) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19
SCHEMBL13928763 0.82 HPGD (0.46) POLBCYP3A4CYP2C9HPGDMEN1
SCHEMBL4218054 0.81 MCHR1 (0.52) HPGDALDH1A1
SCHEMBL4207381 0.81 HPGD (0.45) HPGDDRD2DRD4
SCHEMBL4204597 0.78 HPGD (0.42) SMN1; SMN2POLBCYP3A4CYP2C9CYP2C19

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-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US disclosed
US-7488738-B2 Aminophenoxyacetic acid derivatives and pharmaceutical composition containing thereof ASUBIO PHARMA CO., LTD. (JP) 2009-02-10 — — US disclosed
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