SCHEMBL11241837

SCHEMBL11241837

CCCCC(CCCC)OC(=O)C1C=CCCC1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.33
EPHX2 P34913 1/20 0.32
S1PR5 Q9H228 1/20 0.31
PRKCA P17252 1/20 0.31
PRKCD Q05655 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPT P10636 1/20 0.31
METAP1 P53582 1/20 0.31
PSMB11 A5LHX3 1/20 0.30
PSMA7 O14818 1/20 0.30
PSMB1 P20618 1/20 0.30
PSMA1 P25786 1/20 0.30
PSMA2 P25787 1/20 0.30
PSMA3 P25788 1/20 0.30
PSMA4 P25789 1/20 0.30
PSMB8 P28062 1/20 0.30

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
SCHEMBL6560682 0.95 S1PR5 (0.34) POLBS1PR5USP2ALDH1A1ALOX15
SCHEMBL13571262 0.83 MAPT (0.31) MAPT
SCHEMBL2848204 0.81 CYP3A4 (0.45) MAPK1ALDH1A1TDP1
SCHEMBL13571378 0.80 MAPT (0.33) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL7933762 0.80 MAPT (0.33) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL6322622 0.80 MAPK1 (0.40) MAPK1POLBS1PR5USP2ALDH1A1
SCHEMBL6318600 0.79 MAPT (0.36) POLBALDH1A1TDP1MAPT
SCHEMBL13571631 0.77 MAPT (0.35) MAPT
SCHEMBL6426882 0.77 PPARG (0.43) S1PR5
Butane SCHEMBL11241850 0.77 PPARG (0.40) MAPK1POLBS1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4314946-A Process for the continuous separation of maleic anhydride from process gases FTALITAL PRODOTTI CHIMICI SPECIALI S.P.A. (IT) 1982-02-09 US disclosed