SCHEMBL9202196

SCHEMBL9202196

CCc1cc(C=CC(=O)c2ccc(N)cc2)c(OC(C)C)cc1O.Cc1cc(C=CC(=O)c2ccc(N)cc2)c(OC(C)C)cc1O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 14/20 0.51
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
DPP4 P27487 2/20 0.43

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
SCHEMBL9202191 1.00 PTPN1 (0.51) PTPN1CTSLCTSBDPP4
SCHEMBL7186210 0.95 PTPN1 (0.56) PTPN1CTSLCTSBDPP4
SCHEMBL7186215 0.95 PTPN1 (0.56) PTPN1CTSLCTSBDPP4
SCHEMBL7187714 0.93 PTPN1 (0.58) PTPN1CTSLCTSBDPP4
SCHEMBL7187712 0.93 PTPN1 (0.58) PTPN1CTSLCTSBDPP4
SCHEMBL7190780 0.88 PTPN1 (0.53) PTPN1CTSLCTSBDPP4
SCHEMBL7190785 0.88 PTPN1 (0.53) PTPN1CTSLCTSBDPP4
SCHEMBL7187201 0.86 PTPN1 (0.60) PTPN1CTSLCTSBDPP4
SCHEMBL7187196 0.86 PTPN1 (0.60) PTPN1CTSLCTSBDPP4
SCHEMBL7191078 0.84 PTPN1 (0.55) PTPN1CTSLCTSB

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