SCHEMBL7931938

SCHEMBL7931938

COCOc1ccc(-c2ccc(C)cc2)c(C=CI)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.39
MAOB P27338 2/20 0.36
BACE1 P56817 2/20 0.34
EGFR P00533 2/20 0.34
KDM1A O60341 1/20 0.33
FFAR1 O14842 3/20 0.32
FFAR4 Q5NUL3 3/20 0.32
RELA Q04206 1/20 0.32
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7931935 1.00 FYN (0.39) FYNMAOBBACE1EGFRKDM1A
SCHEMBL7929341 0.89 FYN (0.39) FYNMAOBBACE1KDM1ASMN1; SMN2
SCHEMBL6473730 0.89 FYN (0.37) FYNMAOBBACE1EGFRKDM1A
SCHEMBL6473343 0.89 FYN (0.37) FYNMAOBBACE1EGFRKDM1A
SCHEMBL7929345 0.89 FYN (0.39) FYNMAOBBACE1KDM1ASMN1; SMN2
SCHEMBL6479157 0.83 FYN (0.40) FYNMAOBEGFRKDM1APOLB
SCHEMBL6473346 0.81 FYN (0.37) FYNMAOBEGFRKDM1A
SCHEMBL6472740 0.80 FYN (0.38) FYNMAOBBACE1EGFRKDM1A
SCHEMBL7929362 0.79 FYN (0.38) FYNBACE1EGFRFFAR1FFAR4
SCHEMBL7929366 0.79 FYN (0.38) FYNBACE1EGFRFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 EP disclosed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 US disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 EP disclosed