SCHEMBL10437178

SCHEMBL10437178

CCCCCCC#Cc1ccccc1C#Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49
KCNH2 Q12809 2/20 0.49
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
CYP3A4 P08684 6/20 0.47
TSHR P16473 1/20 0.47
MMP2 P08253 2/20 0.47
MMP12 P39900 2/20 0.47
KDM4E B2RXH2 4/20 0.45
MAPT P10636 4/20 0.45
HSD17B10 Q99714 3/20 0.45
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
HPGD P15428 2/20 0.45
ALOX12 P18054 1/20 0.45
CYP2C9 P11712 4/20 0.44
CYP2C19 P33261 4/20 0.44
CYP1A2 P05177 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL10437174 1.00 CYSLTR2 (0.49) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL10437177 1.00 CYSLTR2 (0.49) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL10437176 0.98 CYSLTR2 (0.47) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL10437184 0.93 CYP3A4 (0.49) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL6371432 0.89 KCNH2 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL4073903 0.88 FFAR1 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL9015870 0.88 FFAR1 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL4071200 0.88 FFAR1 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL7139040 0.88 FFAR1 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4
SCHEMBL2027461 0.88 FFAR1 (0.58) CYSLTR2CYSLTR1KCNH2FFAR1FFAR4

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
EP-0377516-A2 Liquid crystal compounds having high optical anisotropy Chisso Corporation (JP) 1990-07-11 EP disclosed