SCHEMBL8999119

SCHEMBL8999119

Cc1ccc(/C(=C/C#N)c2ccccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
ALDH1A1 P00352 4/20 0.53
LMNA P02545 3/20 0.53
MEN1 O00255 3/20 0.53
NFKB1 P19838 2/20 0.53
CHRM1 P11229 1/20 0.53
ADRA2B P18089 1/20 0.53
SLC6A4 P31645 1/20 0.53
ADRA1A P35348 1/20 0.53
HRH1 P35367 1/20 0.53
OPRK1 P41145 1/20 0.53
KCNH2 Q12809 1/20 0.53
CYP2D6 P10635 1/20 0.53
TSHR P16473 1/20 0.53
THPO P40225 1/20 0.53
GMNN O75496 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
RAB9A P51151 5/20 0.44

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
SCHEMBL8999123 1.00 KMT2A (0.53) KMT2AALDH1A1LMNAMEN1NFKB1
SCHEMBL10620312 0.87 RAB9A (0.49) KMT2AALDH1A1LMNAMEN1NFKB1
SCHEMBL24704170 0.87 RAB9A (0.49) KMT2AALDH1A1LMNAMEN1NFKB1
SCHEMBL10620307 0.87 RAB9A (0.49) KMT2AALDH1A1LMNAMEN1NFKB1
SCHEMBL24704166 0.84 RAB9A (0.50) KMT2AALDH1A1LMNAMEN1RAB9A
SCHEMBL8999182 0.79 PDE4A (0.60) KMT2ALMNAMEN1RAB9ANPC1
SCHEMBL8999173 0.79 PDE4A (0.60) KMT2ALMNAMEN1RAB9ANPC1
SCHEMBL4821488 0.78 PDE4A (0.68) RAB9APDE4APDE4BPDE4CPDE4D
SCHEMBL4821491 0.78 PDE4A (0.68) RAB9APDE4APDE4BPDE4CPDE4D
SCHEMBL14189755 0.78 PDE4A (0.55) KMT2AALDH1A1LMNAMEN1NPSR1

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-5554624-A CONGESTIVE HEART FAILURE; HYPOTENSIVE AGENTS J. URIACH & CIA. (ES) 1996-09-10 US disclosed
EP-0669333-A1 New imidazopyridine derivatives as angiotensin II antagonists J. URIACH & CIA. S.A. (ES) 1995-08-30 EP disclosed