SCHEMBL11224338

SCHEMBL11224338

CCC(C)CCOC(=O)C1C=CCCC1C(=O)OCCC(C)CC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL6323144 0.83 PPM1B (0.39) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL11239543 0.82 USP2 (0.35) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL235113 0.80 CHRM2 (0.38) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL809881 0.80 ESR1 (0.36) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL1456607 0.80 ESR1 (0.36) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL11658814 0.80 ESR1 (0.36) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL5084661 0.80 MAPT (0.36) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL1143090 0.79 ALDH1A1 (0.47) USP2ALDH1A1ALOX15TDP1MAPT
Water SCHEMBL28137663 0.79 ESR1 (0.36) USP2ALDH1A1ALOX15TDP1MAPT
SCHEMBL9717816 0.78 MAPT (0.33) USP2ALDH1A1ALOX15TDP1MAPT

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