SCHEMBL8644129

SCHEMBL8644129

CCN1CCCC1Oc1ccc(Cc2ccc(F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
SPHK2 Q9NRA0 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37
ADRB2 P07550 1/20 0.37
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
LTA4H P09960 2/20 0.37
FFAR4 Q5NUL3 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL8640957 0.89 LTA4H (0.41) LMNASMN1; SMN2RECQLHRH3LTA4H
SCHEMBL8640526 0.88 LMNA (0.48) LMNASMN1; SMN2RECQLHRH3SPHK2
SCHEMBL8637775 0.88 MAOA (0.44) SMN1; SMN2HRH3SPHK2SPHK1CARM1
SCHEMBL8639270 0.86 LTA4H (0.44) HRH3SPHK2SPHK1CARM1PRMT6
SCHEMBL8637445 0.84 HRH1 (0.46) HRH3LTA4H
SCHEMBL8640950 0.84 SCN3A (0.43) LMNASMN1; SMN2RECQLSPHK2SPHK1
SCHEMBL8640569 0.82 LTA4H (0.48) HRH3LTA4H
SCHEMBL8641269 0.82 LTA4H (0.48) HRH3LTA4H
SCHEMBL8641109 0.80 LTA4H (0.52) HRH3SPHK2LTA4HALDH1A1
SCHEMBL8637805 0.80 HRH3 (0.47) LMNASMN1; SMN2RECQLHRH3

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-5723492-A LTA4 hydrolase inhibitor pharmaceutical compositions and methods of use G.D. SEARLE & CO. (US) 1998-03-03 US disclosed
US-5719306-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed