SCHEMBL8936245

SCHEMBL8936245

CC=CCCCCC=CCC(C)CC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
LTB4R Q15722 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
TERT O14746 2/20 0.31
GMNN O75496 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALOX15 P16050 1/20 0.31
APEX1 P27695 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 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
SCHEMBL2009170 0.84 FAAH (0.46) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL2009172 0.84 FAAH (0.46) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL344586 0.83 FAAH (0.50) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL11973749 0.83 FAAH (0.50) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL344585 0.83 FAAH (0.50) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL11973752 0.83 FAAH (0.50) FFAR1FFAR4TRPV1TERTGMNN
SCHEMBL2001647 0.82 FAAH (0.38) FFAR1FFAR4TRPV1
SCHEMBL2001646 0.82 FAAH (0.38) FFAR1FFAR4TRPV1
SCHEMBL57218 0.81
SCHEMBL57219 0.81

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
WO-1996031563-A1 MODIFIED POLYOLEFINS EXXON CHEMICAL PATENTS INC. (US) 1996-10-10 WO disclosed