SCHEMBL5350171

SCHEMBL5350171

CC(C)=CCCC(C)=CCCC(C)=CCC1C=CC=C(C(=O)O)C1=S

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
HIF1A Q16665 2/20 0.41
ALDH1A1 P00352 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FNTA P49354 5/20 0.40
FNTB P49356 5/20 0.40
TRPA1 O75762 2/20 0.39
MAPT P10636 2/20 0.39
ICMT O60725 1/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
CDK2 P24941 1/20 0.39

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
SCHEMBL9996000 0.71 TSHR (0.30) TSHRHSD17B10
Squalene SCHEMBL1298084 0.65 KMT2A (0.81) CYP3A4ALDH1A1ALOX15FNTAFNTB
Squalene SCHEMBL1298088 0.65 KMT2A (0.81) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL31652308 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL5080365 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL29595985 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL458220 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL20435504 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL1395165 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB
SCHEMBL1952603 0.63 FNTA (0.72) CYP3A4ALDH1A1ALOX15FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39682-E1 Farnesyl derivatives and pharmaceutical compositions containing them RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2007-06-05 US disclosed
EP-0729354-B1 FARNESYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM UNIV RAMOT (IL) 2002-02-06 EP disclosed
US-5705528-A ENZYME INHIBITORS USEFUL IN CANCER THERAPY RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT (IL) 1998-01-06 US disclosed