SCHEMBL6495081

SCHEMBL6495081

O=C1N=C(Cc2ccccc2)C(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 1/20 0.44
CALM1 P0DP23 1/20 0.42
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
ELANE P08246 1/20 0.39
CTRC Q99895 3/20 0.37
CYP2C9 P11712 2/20 0.37
DAO P14920 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PARP1 P09874 1/20 0.36
AR P10275 1/20 0.36
DHFR P00374 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
IDH1 O75874 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10733624 0.74 CALM1 (0.50) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL305339 0.72 CALM1 (0.52) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL8132266 0.69 CALM1 (0.55) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL2339223 0.68 CALM1 (0.42) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL6491993 0.67 CALM1 (0.41) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL11685926 0.65 DHFR (0.52) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL991827 0.65 MAOA (0.50) MAOAMAOB
SCHEMBL759000 0.64 CALM1 (0.38) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL10714727 0.64 CALM1 (0.42) SORT1CALM1KMT2AMEN1ELANE
SCHEMBL304780 0.64 TP53 (0.44) SORT1CALM1ELANECTRCCYP2C9

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
EP-0962263-B1 Method and installation for removing hazardous coatings MIEDEN JOHANNES-ALBERT (DE) 2004-12-01 EP claimed
EP-0176963-B1 PROCESS AND APPARATUS FOR THE SEPARATION OF A COMPLEXLY COMPOSED LOAD FROM LIQUID WASTES SUCH AS INDUSTRIAL WASTE WATERS AND SANITARY LANDFILL LEACHATES von Beckerath, Kurt, Dr.rer.nat.,Dipl.-Chem. (DE) 1991-07-24 EP claimed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed