SCHEMBL10691844

SCHEMBL10691844

c1ccc(-n2cnc3ncnc-3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.45
HPGD P15428 4/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
TSHR P16473 3/20 0.45
ALOX15 P16050 1/20 0.45
NOTUM Q6P988 1/20 0.44
MAPT P10636 5/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
GRM5 P41594 1/20 0.40
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALOX15B O15296 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL458419 0.82 NPC1 (0.46) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL6560509 0.78 KDM4A (0.51) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL17279827 0.77 GRM5 (0.48) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL2396469 0.74 CYP11B1 (0.44) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL16073117 0.74 NPC1 (0.47) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL6758198 0.74 MEN1 (0.45) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL9542935 0.73 HTT (0.43) SMN1; SMN2HPGDTSHRNOTUMMAPT
SCHEMBL6832118 0.72 KCNJ1 (0.44) SMN1; SMN2HPGDNPC1RAB9ATSHR
SCHEMBL4549490 0.72 HPGDS (0.50) SMN1; SMN2HPGDNPC1RAB9AMAPT
SCHEMBL2210435 0.71 SMN1; SMN2 (0.47) SMN1; SMN2HPGDNPC1RAB9ATSHR

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-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed