SCHEMBL7185448

SCHEMBL7185448

C=CCOc1ccc(C(=O)C=Cc2cc(OC(C)(C)C)ccc2OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.58
ABCG2 Q9UNQ0 1/20 0.51
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
ATM Q13315 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
DPP4 P27487 3/20 0.46

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
SCHEMBL7796279 0.91 PTPN1 (0.55) PTPN1LMNAMAPTSMN1; SMN2DPP4
SCHEMBL7187132 0.91 PTPN1 (0.55) PTPN1LMNAMAPTSMN1; SMN2DPP4
SCHEMBL9113597 0.88 PTPN1 (0.55) PTPN1ABCG2KDM4ELMNAMAPT
SCHEMBL9113604 0.88 PTPN1 (0.55) PTPN1ABCG2KDM4ELMNAMAPT
SCHEMBL7191031 0.87 DPP4 (0.59) PTPN1ABCG2KDM4ELMNAMAPT
SCHEMBL7191026 0.87 DPP4 (0.59) PTPN1ABCG2KDM4ELMNAMAPT
SCHEMBL9114109 0.87 PTPN1 (0.52) PTPN1ABCG2KDM4ELMNAMAPT
SCHEMBL7184626 0.87 PTPN1 (0.56) PTPN1ABCG2DPP4
SCHEMBL7184629 0.87 PTPN1 (0.56) PTPN1ABCG2DPP4
SCHEMBL9111732 0.86 PTPN1 (0.56) PTPN1ABCG2KDM4ELMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6603046-B1 The invention is drawn to novel bis-aromatic a, beta -unsaturated ketones. The compounds are useful in the treatment and prophylaxis of diseases caused by parasites or bacteria. LICA PHARMACEUTICALS A/S (DK) 2003-08-05 US disclosed
EP-0634927-B1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA LICA PHARMACEUTICALS AS (DK) 2001-07-04 EP disclosed
US-5985935-A PARASITICIDES OR BACTERICIDES STATENS SERUMINSTITUT (DK) 1999-11-16 US disclosed
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