SCHEMBL10695348

SCHEMBL10695348

N#Cc1nc(-c2cccc(Cl)c2)[nH]c1C#N

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
MGAM O43451 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
ALOX15 P16050 1/20 0.46
ADORA2A P29274 3/20 0.46
ADORA1 P30542 3/20 0.46
ADORA2B P29275 2/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MPI P34949 1/20 0.45
GFER P55789 1/20 0.45
PARP1 P09874 1/20 0.45
PIN1 Q13526 1/20 0.45
HRH1 P35367 1/20 0.44
IDO1 P14902 2/20 0.44
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
NUDT1 P36639 1/20 0.42
HPGD P15428 2/20 0.42

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
SCHEMBL10697175 0.83 DCUN1D1 (0.46) GAAALOX15KDM4EALDH1A1MPI
SCHEMBL10694148 0.82 MGAM (0.47) GAAMGAMSIMGAM2ADORA2A
SCHEMBL10695576 0.81 ERBB2 (0.47) GAAMGAMSIMGAM2ALOX15
SCHEMBL7074324 0.80 ALDH1A1 (0.49) GAAALDH1A1PARP1PIN1HPGD
SCHEMBL10696178 0.80 ALOX15 (0.45) ALOX15HRH1IDO1HPGDLMNA
SCHEMBL10694557 0.78 HPGD (0.53) GAAADORA2AADORA1ADORA2BKDM4E
SCHEMBL10695152 0.78 PARP1 (0.57) GAAMGAMSIMGAM2ADORA2A
SCHEMBL10696460 0.76 MAPT (0.55) ALDH1A1LMNAHTTNPBWR1
SCHEMBL9220197 0.76 MEN1 (0.51) GAAKDM4EHPGDLMNANPBWR1
SCHEMBL16661580 0.74 NPY5R (0.49) KDM4EALDH1A1HPGDHTT

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
EP-0269238-A1 Imidazoles and their compositions for plant growth regulation MAY & BAKER LIMITED (GB) 1988-06-01 EP disclosed
EP-0259782-A1 Naphthalene and indane derivatives, medicaments containing these compounds and processes for their preparation Dr. Karl Thomae GmbH (DE) 1988-03-16 EP disclosed