SCHEMBL10836337

SCHEMBL10836337

CCOC(=O)C(C)(C/C=C(/C)Cl)C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.41
MMP8 P22894 2/20 0.41
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP4F2 P78329 3/20 0.36
CYP4A11 Q02928 3/20 0.36
THRB P10828 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HTR2A P28223 1/20 0.36
PMP22 Q01453 1/20 0.36
PPARA Q07869 1/20 0.36
HTT P42858 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GLO1 Q04760 1/20 0.33

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
SCHEMBL10836349 1.00 PKM (0.41) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL10836355 1.00 PKM (0.41) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL10964113 0.91 MMP8 (0.38) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL10964108 0.91 MMP8 (0.38) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL335584 0.85 PKM (0.43) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL3737736 0.78 MMP8 (0.41) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL11136882 0.76 MMP8 (0.40) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL13287418 0.75 MMP8 (0.39) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL2438993 0.75 MMP8 (0.39) PKMMMP8KDM4EALDH1A1LMNA
SCHEMBL29220128 0.75 MMP8 (0.43) PKMMMP8KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567195-A Azaprostacyclins, their preparation and pharmaceutical use SCHERING, AKTIENGESELLSCHAFT (DE) 1986-01-28 US disclosed
EP-0059756-B1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 1985-08-28 EP disclosed
US-4532236-A Certain prostacyclins and their blood-pressure-lowering and thrombocyte-aggregation-inhibiting compositions and methods SCHERING AKTIENGESELLSCHAFT (DE) 1985-07-30 US disclosed
US-4466969-A 7-Oxoprostacyclin derivatives and their use as hypotensives and bronchodilators SCHERING AKTIENGESELLSCHAFT (DE) 1984-08-21 US disclosed
US-4446147-A Azaprostacyclins, their preparation and pharmaceutical use SCHERING AKTIENGESELLSCHAFT (DE) 1984-05-01 US disclosed
EP-0059756-A1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF. SCHERING AG (DE) 1982-09-15 EP disclosed
WO-1982001002-A1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF NICKOLSON R 1982-04-01 WO disclosed