SCHEMBL6595620

SCHEMBL6595620

O=C1NC(=O)C(=Cc2ccc(OC3CCN(C(=O)Nc4ccccc4)CC3)cc2)S1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.57
HDAC4 P56524 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
GPR119 Q8TDV5 8/20 0.52
AKR1B1 P15121 1/20 0.50
FAAH O00519 1/20 0.50
NAMPT P43490 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
CISD1 Q9NZ45 1/20 0.48

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
SCHEMBL6595615 1.00 HPGD (0.57) HPGDHDAC4HDAC8GPR119AKR1B1
SCHEMBL29029524 0.88 PIM1 (0.58) HPGDGPR119FAAH
SCHEMBL29029526 0.88 PIM1 (0.58) HPGDGPR119FAAH
SCHEMBL6598068 0.85 GPR119 (0.56) HPGDGPR119MAOAMAOB
SCHEMBL6598426 0.85 GPR119 (0.56) HPGDGPR119MAOAMAOB
SCHEMBL6596314 0.84 HPGD (0.60) HPGDGPR119AKR1B1
SCHEMBL6596488 0.84 HPGD (0.60) HPGDGPR119AKR1B1
SCHEMBL30864157 0.82 HPGD (0.66) HPGDGPR119AKR1B1
SCHEMBL30440951 0.82 HPGD (0.66) HPGDGPR119AKR1B1
SCHEMBL6596168 0.82 FAAH (0.58) FAAHNAMPT

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-0981526-B1 NOVEL ANTIDIABETIC COMPOUNDS HAVING HYPOLIPIDAEMIC, ANTIHYPERTENSIVE PROPERTIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM REDDYS LAB LTD DR (IN) 2004-02-25 EP claimed
EP-0981526-B1 NOVEL ANTIDIABETIC COMPOUNDS HAVING HYPOLIPIDAEMIC, ANTIHYPERTENSIVE PROPERTIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM REDDYS LAB LTD DR (IN) 2004-02-25 EP disclosed