SCHEMBL19624418

SCHEMBL19624418

C/C=C/C(=O)OCc1cc(C2CCC(C)CC2)ccc1-c1ccc(OCCO)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.41
RAB9A P51151 1/20 0.34
CSF1R P07333 2/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP14 P50281 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
GSTP1 P09211 1/20 0.33
FASN P49327 1/20 0.33
HRH3 Q9Y5N1 4/20 0.32
ESR2 Q92731 1/20 0.32
FFAR1 O14842 1/20 0.32
ALDH2 P05091 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL19804599 0.91 FFAR4 (0.46) FFAR4RAB9ACSF1RMMP1MMP2
SCHEMBL19796909 0.87 FFAR4 (0.39) FFAR4RAB9AALDH2
SCHEMBL19804023 0.80 FFAR4 (0.42) FFAR4RAB9AGSTP1FFAR1ALDH2
SCHEMBL19624624 0.79 FFAR4 (0.40) FFAR4CSF1RMRGPRX4FASNESR2
SCHEMBL19796454 0.77 FFAR1 (0.39) FFAR4FFAR1
SCHEMBL19804771 0.74 FFAR4 (0.48) FFAR4RAB9AHRH3
SCHEMBL19804664 0.73 FFAR4 (0.42) FFAR4RAB9ACSF1RMMP1MMP2
SCHEMBL8681748 0.73 ESR2 (0.53) RAB9AHRH3ESR2
SCHEMBL19796758 0.73 TSHR (0.35) RAB9ACSF1RMRGPRX4ESR2
SCHEMBL19804576 0.72 FFAR4 (0.48) FFAR4RAB9ACSF1RHRH3ALDH2

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-3246305-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-11-22 EP disclosed