SCHEMBL7987765

SCHEMBL7987765

Fc1ccc(-c2ccccc2COCCCc2c[nH]cn2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
GBA1 P04062 2/20 0.35
LCT P09848 2/20 0.35
SI P14410 2/20 0.35
UGCG Q16739 2/20 0.35
GBA2 Q9HCG7 2/20 0.35
MGAM O43451 1/20 0.35
LTB4R Q15722 2/20 0.33
LTB4R2 Q9NPC1 2/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
TACR1 P25103 1/20 0.33
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
QPCT Q16769 1/20 0.32
SYK P43405 2/20 0.32
MC4R P32245 2/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 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
SCHEMBL4382490 0.78 FFAR1 (0.36) FFAR1FFAR4QPCTMC4R
SCHEMBL7972615 0.76 HRH3 (0.37) HRH4HRH3
SCHEMBL7974330 0.76 CNR1 (0.41) FFAR1
SCHEMBL7988621 0.75 ALDH1A1 (0.36) HRH4HRH3
Proxyfan SCHEMBL4072620 0.74 HRH3 (0.54) GBA1HRH4HRH3
SCHEMBL7961327 0.74 RAB9A (0.43) HRH3
SCHEMBL7960978 0.70 HRH3 (0.47) HRH4HRH3
SCHEMBL7987762 0.70 MAPK1 (0.52) HRH4HRH3
SCHEMBL7987288 0.70 MAOB (0.38) FFAR1FFAR4
Proxyfan SCHEMBL15130144 0.69 HRH3 (0.48) HRH4HRH3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US claimed
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed