SCHEMBL9743301

SCHEMBL9743301

CCOCCSc1nc2ccc(OC)cc2[nH]1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2E1 P05181 18/20 0.76
CYP2C8 P10632 18/20 0.76
CYP2D6 P10635 18/20 0.76
CYP2C9 P11712 18/20 0.76
CYP2B6 P20813 18/20 0.76
CYP2C19 P33261 18/20 0.76
CYP1A2 P05177 17/20 0.76
CYP3A4 P08684 16/20 0.76
LMNA P02545 1/20 0.66
BRS3 P32247 1/20 0.62
NPC1 O15118 1/20 0.57
HPGD P15428 1/20 0.57
RAB9A P51151 1/20 0.57

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
SCHEMBL9743293 0.90 CYP2E1 (0.61) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL14304388 0.84 CYP2E1 (0.90) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL9744394 0.83 HPGD (0.57) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL22468990 0.82 CYP2E1 (1.00) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL8768283 0.81 LMNA (0.97) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL9439554 0.80 SMN1; SMN2 (0.71) LMNANPC1HPGDRAB9A
SCHEMBL5391948 0.78 CYP1A2 (0.76) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL17153978 0.77 CYP2E1 (0.72) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL23657567 0.77 MAPT (0.78) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6
SCHEMBL30406237 0.77 NPC1 (0.69) CYP2E1CYP2C8CYP2D6CYP2C9CYP2B6

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-5171746-A THIAZOLE AND IMIDAZOLE DERIVATIVES AND ANTIULCER COMPOSITION CONTAINING SAME MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-12-15 US disclosed
EP-0452076-A1 Thiazole and imidazole derivatives and antiulcer composition containing same MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-10-16 EP disclosed