SCHEMBL9744394

SCHEMBL9744394

CCOCCSc1nc2ccc(Cl)cc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
RAB9A P51151 2/20 0.55
HSD17B10 Q99714 2/20 0.55
CYP1A2 P05177 7/20 0.52
CYP2E1 P05181 7/20 0.52
CYP3A4 P08684 7/20 0.52
CYP2C8 P10632 7/20 0.52
CYP2D6 P10635 7/20 0.52
CYP2C9 P11712 7/20 0.52
CYP2B6 P20813 7/20 0.52
CYP2C19 P33261 7/20 0.52
NPC1 O15118 1/20 0.52
AR P10275 3/20 0.52
MAPT P10636 4/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 3/20 0.48

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
SCHEMBL9744385 0.90 AR (0.52) HPGDSMN1; SMN2RAB9AHSD17B10CYP1A2
SCHEMBL9743301 0.83 CYP2E1 (0.76) HPGDRAB9ACYP1A2CYP2E1CYP3A4
SCHEMBL9439554 0.81 SMN1; SMN2 (0.71) HPGDSMN1; SMN2RAB9ANPC1AR
SCHEMBL14304934 0.80 RAB9A (0.63) HPGDSMN1; SMN2RAB9AHSD17B10CYP1A2
SCHEMBL9743293 0.75 CYP2E1 (0.61) HPGDSMN1; SMN2RAB9ACYP1A2CYP2E1
SCHEMBL5112528 0.75 AR (0.70) HPGDSMN1; SMN2CYP1A2CYP2E1CYP3A4
SCHEMBL6757973 0.75 HSD17B10 (0.56) HPGDSMN1; SMN2RAB9AHSD17B10CYP1A2
SCHEMBL8667804 0.74 HPGD (1.00) HPGDSMN1; SMN2RAB9AHSD17B10CYP1A2
SCHEMBL17153982 0.73 HPGD (0.74) HPGDSMN1; SMN2RAB9AHSD17B10CYP3A4
SCHEMBL9743830 0.72 ALDH1A1 (0.44) HPGDSMN1; SMN2RAB9AHSD17B10CYP1A2

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