SCHEMBL9345890

SCHEMBL9345890

CCCCCC(C)(C)Oc1ccc([S])cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.35
CNR1 P21554 10/20 0.35
S1PR1 P21453 4/20 0.35
S1PR4 O95977 3/20 0.35
S1PR3 Q99500 3/20 0.35
S1PR5 Q9H228 2/20 0.35
NR5A1 Q13285 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
SPHK2 Q9NRA0 1/20 0.33
LTA4H P09960 1/20 0.33

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
SCHEMBL1454452 0.81 LTA4H (0.46) CNR2CNR1PPARGPPARALTA4H
SCHEMBL7205750 0.80 ESR1 (0.37) CNR2CNR1S1PR1S1PR4S1PR3
SCHEMBL3294369 0.79 S1PR1 (0.33) CNR2CNR1S1PR1S1PR4S1PR3
SCHEMBL9115557 0.79 SPHK2 (0.33) CNR2CNR1S1PR1S1PR4S1PR3
SCHEMBL18727664 0.78 CHRNB2 (0.40) S1PR1S1PR4S1PR3S1PR5NR5A1
SCHEMBL5353479 0.77 TP53 (0.36) S1PR1S1PR4S1PR3S1PR5
SCHEMBL5352670 0.77 CHRNB2 (0.39) CNR2CNR1S1PR1S1PR4S1PR3
SCHEMBL5495925 0.77 TP53 (0.58)
SCHEMBL5355560 0.77 CHRNB2 (0.39) CNR2CNR1S1PR1S1PR4S1PR3
SCHEMBL3296586 0.77 CNR2 (0.33) CNR2CNR1S1PR1S1PR4S1PR3

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
EP-0307927-B1 Silver halide color photosensitive material FUJI PHOTO FILM CO LTD (JP) 1994-06-22 EP disclosed
EP-0307927-A2 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1989-03-22 EP disclosed