SCHEMBL9205346

SCHEMBL9205346

C/C=C/Cc1cc(/C=C/C(=O)c2ccc(NC)cc2)c(OC)cc1O.CCOc1cc(O)c(C)cc1/C=C/C(=O)c1ccc(NC)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.57
DPP4 P27487 2/20 0.49

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
SCHEMBL9205352 1.00 PTPN1 (0.57) PTPN1DPP4
SCHEMBL7178802 0.92 PTPN1 (0.56) PTPN1DPP4
SCHEMBL7178805 0.92 PTPN1 (0.56) PTPN1DPP4
SCHEMBL9199077 0.91 PTPN1 (0.63) PTPN1DPP4
SCHEMBL9199081 0.91 PTPN1 (0.63) PTPN1DPP4
SCHEMBL7186110 0.90 PTPN1 (0.62) PTPN1
SCHEMBL7186104 0.90 PTPN1 (0.62) PTPN1
SCHEMBL7182869 0.86 DPP4 (0.52) PTPN1DPP4
SCHEMBL7182866 0.86 DPP4 (0.52) PTPN1DPP4
SCHEMBL7189316 0.85 PTPN1 (0.49) PTPN1DPP4

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-0634927-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1995-01-25 EP disclosed
WO-1993017671-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1993-09-16 WO disclosed