SCHEMBL9667153

SCHEMBL9667153

c1ccc(-n2c(Cc3ccccn3)nc3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.49
HTT P42858 1/20 0.49
PDE7A Q13946 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 2/20 0.43
PDE10A Q9Y233 3/20 0.43
PIK3CD O00329 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 1/20 0.41
NTRK1 P04629 1/20 0.41
NTRK2 Q16620 1/20 0.41
CYP1A2 P05177 1/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL8022032 0.81 NPC1 (0.65) ALDH1A1MAPK1HTTNPC1RAB9A
SCHEMBL2757849 0.77 LMNA (0.73) ALDH1A1HTTRAB9AKDM4ECYP1A2
SCHEMBL11901939 0.76 TSHR (0.56) ALDH1A1MAPK1HTTNPC1RAB9A
SCHEMBL259639 0.76 MEN1 (0.58) ALDH1A1MAPK1HTTNPC1RAB9A
SCHEMBL426154 0.76 MAPK1 (0.56) MAPK1HTTNPC1RAB9ATSHR
SCHEMBL11901604 0.76 MAPK1 (0.56) ALDH1A1MAPK1HTTNPC1RAB9A
SCHEMBL762447 0.76 MAPK1 (0.66) ALDH1A1MAPK1HTTRAB9ATSHR
SCHEMBL10893819 0.75 AOC2 (0.65) ALDH1A1MAPK1HTTPDE7ANPC1
SCHEMBL20715440 0.75 ALDH1A1 (0.46) ALDH1A1HTTNPC1RAB9ATSHR
SCHEMBL10897181 0.75 MAPK1 (0.47) ALDH1A1MAPK1HTTNPC1RAB9A

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-0270091-B1 IMIDAZOLE DERIVATIVES, PROCESSES FOR THE PREPARATION OF THE SAME, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME, THE USE OF THE SAME FOR THE MANUFACTURE OF MEDICAMENTS OF THERAPEUTIC VALUE, AND INTERMEDIATES FORMED DURING SAID PROCESSES TANABE SEIYAKU CO., LTD. (JP) 1992-11-11 EP disclosed
US-4563455-A Antiulcer fused imidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-07 US disclosed
EP-0125756-A2 Fused imidazole compounds, processes for the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-11-21 EP disclosed