SCHEMBL8909686

SCHEMBL8909686

C=C[C](C)CCCCCO

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
SQLE Q14534 3/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30

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
SCHEMBL9343994 0.78
SCHEMBL202195 0.74
SCHEMBL21670433 0.74 ALDH1A1 (0.33) ALDH1A1TSHRTP53
SCHEMBL11724068 0.72 GPR84 (0.40) GPR84FFAR1FFAR4SQLELMNA
1,6-Hexanediol SCHEMBL29249024 0.72 TSHR (0.50) GPR84FFAR1FFAR4SQLELMNA
1,6-Hexanediol SCHEMBL22977579 0.72 TSHR (0.50) GPR84FFAR1FFAR4SQLELMNA
1,6-Hexanediol SCHEMBL21353993 0.72 TSHR (0.50) GPR84FFAR1FFAR4SQLELMNA
Propene SCHEMBL28542606 0.72 TSHR (0.50) GPR84FFAR1FFAR4SQLELMNA
SCHEMBL466592 0.70 GPR84 (0.43) GPR84FFAR1FFAR4SQLELMNA
SCHEMBL466671 0.70 GPR84 (0.43) GPR84FFAR1FFAR4SQLELMNA

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-5684074-A COPOLYMER COATING AND ALKYL SILICATE WITH POLYETHER SILICONE OIL CENTRAL GLASS COMPANY, LIMITED (JP) 1997-11-04 US disclosed