SCHEMBL6958945

SCHEMBL6958945

CN(Cc1ccc2cc(C=O)cnc2c1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDGFRB P09619 2/20 0.39
PDGFRA P16234 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RAB9A P51151 4/20 0.38
IP6K1 Q92551 1/20 0.38
DHFR P00374 1/20 0.38
TAAR1 Q96RJ0 2/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GBA1 P04062 1/20 0.35

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
SCHEMBL6958317 0.80 CRHBP (0.40) CRHBPCRHR2MEN1KMT2AIP6K1
SCHEMBL6960807 0.79 HPGDS (0.48) CRHBPCRHR2ALDH1A1KDM4E
SCHEMBL6956099 0.79 PPARG (0.52) MEN1KMT2ARAB9ANPC1
SCHEMBL6956100 0.79 PPARG (0.52) MEN1KMT2ARAB9ANPC1
SCHEMBL17508122 0.77 CRHBP (0.57) CRHBPCRHR2ALDH1A1KDM4EMEN1
SCHEMBL18002715 0.76 MAOA (0.46) CRHBPCRHR2ALDH1A1KDM4EKMT2A
SCHEMBL18033717 0.74 PDGFRB (0.37) ALDH1A1KDM4EPDGFRBPDGFRAMEN1
SCHEMBL24982167 0.74 EGFR (0.54) ALDH1A1KDM4EPDGFRBPDGFRAMEN1
SCHEMBL8824924 0.72 MCHR1 (0.35) CRHBPCRHR2ALDH1A1KDM4EMEN1
SCHEMBL9797715 0.71 PDGFRB (0.42) ALDH1A1KDM4EPDGFRBPDGFRAKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
US-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed