SCHEMBL7528964

SCHEMBL7528964

Cc1ccc2c(c1)N(CCC(O)CO)C(C)(C)CC2C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.41
DRD4 P21917 2/20 0.41
KDM4E B2RXH2 1/20 0.39
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL30887165 0.85 DRD2 (0.46) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL596045 0.85 DRD2 (0.46) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL10233648 0.83 DRD2 (0.44) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL6290255 0.81 KDM4E (0.32) KDM4EMAPT
SCHEMBL9847654 0.81 DRD2 (0.47) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL9636420 0.80 DRD2 (0.44) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL11183111 0.80 DRD2 (0.46) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL9422072 0.80 DRD2 (0.43) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL6141223 0.79 DRD2 (0.43) DRD2DRD4KDM4ECRHBPCRHR2
SCHEMBL11880422 0.78 DRD2 (0.44) DRD2DRD4KDM4ECRHBPCRHR2

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
EP-1181004-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES AND DYEING METHOD USING SAME L'OREAL (FR) 2002-02-27 EP claimed
WO-2001066072-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES AND DYEING METHOD USING SAME L'OREAL (FR) 2001-09-13 WO claimed