SCHEMBL8657457

SCHEMBL8657457

CN(C)c1[c]cc(O)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.34
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
CA12 O43570 1/20 0.32
GMNN O75496 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CA3 P07451 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
TYR P14679 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
NFKB1 P19838 1/20 0.32
CA4 P22748 1/20 0.32
CA5A P35218 1/20 0.32

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
SCHEMBL2779576 0.73 ALDH1A1 (0.48) APPALDH1A1TSHRKDM4EMEN1
SCHEMBL8660579 0.73 ALDH1A1 (0.40) ALDH1A1TSHRACHE
SCHEMBL359463 0.71 GAA (0.33) ALDH1A1KDM4ELMNAHPGDALOX15
SCHEMBL8653363 0.71 APP (0.39) APPMEN1CA1CA2KMT2A
SCHEMBL8658604 0.71 CYP2A6 (0.32) ALDH1A1
SCHEMBL7585956 0.70 ALDH1A1 (0.32) ALDH1A1TSHRALOX15HSD17B10
SCHEMBL8657214 0.68 CA1 (0.42) APPALDH1A1KDM4ENPC1CA12
SCHEMBL1122693 0.67
SCHEMBL15475178 0.67 TAAR1 (0.41) ALDH1A1KDM4ENPC1CYP3A4RAB9A
SCHEMBL5673544 0.67 CYP2A6 (0.38) APPALDH1A1TSHRCA12CA2

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
US-5750552-A ANTIULCER AGENTS ARAX CO., LTD. (JP) 1998-05-12 US disclosed
US-5733922-A Imidazole derivative, pharmaceutically acceptable salt thereof, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1998-03-31 US disclosed
EP-0736527-A1 Imadazoline derivative, possible tautomer thereof, process of manufacturing therefor, and vulnerary including such derivative or tautomer ARAX CO., LTD. (JP) 1996-10-09 EP disclosed
EP-0728747-A1 Imidazole derivative, pharmaceutically acceptable salt thereof, process of manufacture therefor, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1996-08-28 EP disclosed