SCHEMBL9345937

SCHEMBL9345937

CCC(C)(C)c1[c]ccc(C(C)(C)CC)c1-c1ccc(C(C)(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.33
GRIA2 P42262 1/20 0.30
GRIA4 P48058 1/20 0.30
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL19480532 0.68 KIF11 (0.52) KIF11MAPTKDM4EALDH1A1HPGD
SCHEMBL677467 0.66
SCHEMBL18092134 0.66 NPC1 (0.33) MAPTSMN1; SMN2
SCHEMBL3625528 0.66 NPC1 (0.52) KIF11MAPTALDH1A1SMN1; SMN2
SCHEMBL1241939 0.65 MAPK1 (0.40) MAPTALDH1A1HTTSMN1; SMN2
SCHEMBL2494471 0.62 CYP2D6 (0.34) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5552840 0.61 NPC1 (0.52) KIF11MAPTSMN1; SMN2
SCHEMBL3292125 0.61 NPC1 (0.52) KIF11MAPTSMN1; SMN2
SCHEMBL6397215 0.61 KIF11 (0.40) KIF11KDM4EALDH1A1HPGDHTT
SCHEMBL3423876 0.60 KIF11 (0.70) KIF11MAPTKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0284081-B1 Silver halide photographic material FUJI PHOTO FILM CO LTD (JP) 1994-08-10 EP disclosed
EP-0283938-B1 SILVER HALIDE COLOR PHOTOGRAPHIC MATERIAL Fuji Photo Film Co., Ltd. (JP) 1992-08-26 EP disclosed
EP-0284081-A2 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1988-09-28 EP disclosed
EP-0283938-A1 Silver halide color photographic material Fuji Photo Film Co., Ltd. (JP) 1988-09-28 EP disclosed