SCHEMBL8115341

SCHEMBL8115341

c1nc(CCC(CCCC2CCCCC2)OC(CCCC2CCCCC2)CCc2c[nH]cn2)c[nH]1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.34
HRH3 Q9Y5N1 7/20 0.34
HTR1A P08908 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
BMP1 P13497 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL4384996 0.99 HRH4 (0.32) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL9850899 0.84 HRH4 (0.40) HRH4HRH3CYP1A2
SCHEMBL7625072 0.81 GPR84 (0.42) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL8524329 0.81 HRH4 (0.41) HRH4HRH3CDK1CCNB1CCNA2
SCHEMBL7971225 0.81 HRH3 (0.40) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL7976777 0.79 HRH3 (0.38) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL7977147 0.78 HRH4 (0.38) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL4379165 0.77
SCHEMBL7618097 0.77 HRH4 (0.33) HRH4HRH3HTR1AHTR1DHTR1B
SCHEMBL7787749 0.74 BMP1 (0.32) BMP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597088-B1 NOVEL IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATIONS INST NAT SANTE RECH MED (FR) 2000-12-06 EP claimed