SCHEMBL7185167

SCHEMBL7185167

C=CCOc1ccc(C(=O)/C=C/c2c(OC)ccc(CCC)c2OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.54
KDM4E B2RXH2 3/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ABCG2 Q9UNQ0 4/20 0.45
MAOB P27338 1/20 0.43
KRAS P01116 1/20 0.43
DPP4 P27487 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7185172 1.00 PTPN1 (0.54) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7186106 0.90 PTPN1 (0.64) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7186112 0.90 PTPN1 (0.64) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7803230 0.88 PTPN1 (0.47) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7192110 0.88 PTPN1 (0.47) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7184195 0.87 PTPN1 (0.46) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7184165 0.87 PTPN1 (0.46) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7185082 0.86 PTPN1 (0.46) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7191600 0.86 PTPN1 (0.46) PTPN1KDM4ELMNAMAPTALDH1A1
SCHEMBL7183818 0.85 PTPN1 (0.45) PTPN1KDM4ELMNAMAPTALDH1A1

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 4 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 claimed
EP-0634927-B1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA LICA PHARMACEUTICALS AS (DK) 2001-07-04 EP claimed
EP-0634927-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1995-01-25 EP claimed
WO-1993017671-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1993-09-16 WO claimed