SCHEMBL9273307

SCHEMBL9273307

C=CCc1cc(C=CC(=O)c2ccc(NC)cc2)c(OCCC)cc1O.CCCOc1cc(O)c(C(C)(C)CC)cc1C=CC(=O)c1ccc(NC)cc1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 20/20 0.54

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
SCHEMBL9273302 1.00 PTPN1 (0.54) PTPN1
SCHEMBL9276395 0.92 PTPN1 (0.64) PTPN1
SCHEMBL9276392 0.92 PTPN1 (0.64) PTPN1
SCHEMBL7186065 0.91 DPP4 (0.49) PTPN1
SCHEMBL7184349 0.91 PTPN1 (0.62) PTPN1
SCHEMBL7184345 0.91 PTPN1 (0.62) PTPN1
SCHEMBL7186059 0.91 DPP4 (0.49) PTPN1
SCHEMBL9270426 0.88 PTPN1 (0.46) PTPN1
SCHEMBL9270820 0.86 PTPN1 (0.43) PTPN1
SCHEMBL9270175 0.85 PTPN1 (0.56) PTPN1

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