SCHEMBL20218708

SCHEMBL20218708

CC(C)=CCC/C(C)=C/CC/C(C)=C/CSCC(C)NC(=O)CCc1cccs1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ICMT O60725 14/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 1/20 0.47
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
MEN1 O00255 1/20 0.40
TRPA1 O75762 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL20218721 0.89 ALDH1A1 (0.61) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL1819477 0.89 ALDH1A1 (0.61) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL1819478 0.89 ALDH1A1 (0.61) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL1819474 0.89 ALDH1A1 (0.61) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL20218641 0.88 ALDH1A1 (0.44) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL21697664 0.84 TRPV1 (0.58) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL20843606 0.82 ICMT (0.47) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL20218711 0.80 MAPT (0.57) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL20218871 0.79 MAPT (0.58) ICMTMAPTALDH1A1FNTAFNTB
SCHEMBL21697697 0.77 MAPT (0.56) ICMTMAPTALDH1A1FNTAFNTB

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-3075248-B1 USE OF ANTI-BACTERIAL AGENTS FOR THE TREATMENT OF EPITHELIAL-RELATED CONDITIONS SIGNUM BIOSCIENCES INC (US) 2019-03-27 EP disclosed
EP-3330252-A2 ISOPRENYL COMPOUNDS AND METHODS THEREOF Signum Biosciences, Inc. (US) 2018-06-06 EP disclosed