SCHEMBL12134366

SCHEMBL12134366

O=C(CBr)CCCCCCCO

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.52
FFAR1 O14842 1/20 0.52
FFAR4 Q5NUL3 1/20 0.52
FAAH O00519 1/20 0.50
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
CAMK2A Q9UQM7 1/20 0.38
TSHR P16473 4/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 3/20 0.35
NFKB1 P19838 1/20 0.35
PMP22 Q01453 1/20 0.35
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL10780606 0.89 FAAH (0.58) GPR84FFAR1FFAR4FAAHTSHR
SCHEMBL14168783 0.89 FAAH (0.58) GPR84FFAR1FFAR4FAAHTSHR
SCHEMBL10777713 0.86 FAAH (0.54) GPR84FFAR1FFAR4FAAHKDM4E
SCHEMBL25212694 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL19066840 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL533292 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL25428960 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL25432514 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL2435216 0.83 GPR84 (0.63) GPR84FFAR1FFAR4KDM4ESMN1; SMN2
SCHEMBL28466238 0.81 FAAH (0.52) GPR84FFAR1FFAR4FAAHKDM4E

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-8063249-B1 Substituted triphenyl butenes OLEMA PHARMACEUTICALS, INC. (US) 2011-11-22 US disclosed