SCHEMBL9748669

SCHEMBL9748669

Cc1cn2cccc(OC(C)c3ccccc3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.40
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 2/20 0.38
TSHR P16473 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
GRM5 P41594 2/20 0.38
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
ADRA2A P08913 1/20 0.35

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
SCHEMBL8559050 0.80 NPC1 (0.36) HTR6NPC1RAB9AALDH1A1KDM4E
SCHEMBL11070005 0.77 NPC1 (0.42) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL14679593 0.76 PSEN1 (0.50) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL10646839 0.71 HRH3 (0.40) HRH3PSEN1PSEN2APH1BNCSTN
SCHEMBL23571422 0.71 PSEN1 (0.39) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL9748555 0.69 ATP4A (0.46) HTR6NPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL8442883 0.69 PSEN1 (0.35) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL9749030 0.69 PSEN1 (0.53) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL3971488 0.68 NPC1 (0.61) NPC1RAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL9707206 0.68 SLC6A2 (0.51) HTR6TP53TSHRHPGDHRH3

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-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed