SCHEMBL8959170

SCHEMBL8959170

CCCCCCCOc1ccc(-c2nnn[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 7/20 0.52
CYP2C9 P11712 6/20 0.52
CYP2C19 P33261 6/20 0.52
CYP3A4 P08684 6/20 0.52
CYP1A2 P05177 6/20 0.52
CYP19A1 P11511 5/20 0.52
HPGD P15428 4/20 0.50
RAB9A P51151 3/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
POLB P06746 1/20 0.50
NR5A1 Q13285 1/20 0.49
RARB P10826 3/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 2/20 0.46
TP53 P04637 2/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL6956902 1.00 CYP2D6 (0.52) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL4820028 1.00 CYP2D6 (0.52) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL16837391 0.99 CYP2D6 (0.51) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL13880484 0.99 CYP2D6 (0.51) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL1639885 0.99 CYP2D6 (0.51) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL6954855 0.95 CYP2D6 (0.56) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL6494392 0.89 RAB9A (0.56) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL6962658 0.83 TSHR (0.54) CYP2C9CYP2C19CYP1A2CYP19A1SMN1; SMN2
SCHEMBL6960023 0.83 TSHR (0.54) CYP2C9CYP2C19CYP1A2CYP19A1SMN1; SMN2
SCHEMBL702808 0.83 ALDH1A1 (0.53) CYP2D6CYP2C9CYP2C19CYP3A4CYP1A2

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-0486025-B1 Photographic elements containing release compounds-I EASTMAN KODAK CO (US) 1996-01-24 EP disclosed
EP-0486025-A1 Photographic elements containing release compounds-I EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-05-20 EP disclosed
US-5034311-A Silver halide emulsion for color photography with novel release compounds for releasing development inhibitors or timing groups EASTMAN KODAK COMPANY (US) 1991-07-23 US disclosed