SCHEMBL8298665

SCHEMBL8298665

Cn1nc(-c2c(F)cccc2F)nc1-c1ccc(OCc2ccc(OC(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.41
TDP2 O95551 1/20 0.40
RHEB Q15382 1/20 0.37
SLC6A4 P31645 1/20 0.37
PTGER1 P34995 1/20 0.37
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
NTRK1 P04629 1/20 0.36
CSF1R P07333 1/20 0.36
NTRK2 Q16620 1/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
ERBB3 P21860 1/20 0.36
ERBB4 Q15303 1/20 0.36
GCGR P47871 2/20 0.36
GRM2 Q14416 1/20 0.36
HCRTR1 O43613 5/20 0.35
HCRTR2 O43614 5/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 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
SCHEMBL8297501 0.96 MRGPRX4 (0.40) MRGPRX4TDP2RHEBSLC6A4PTGER1
SCHEMBL8298176 0.89 MRGPRX4 (0.46) MRGPRX4PPARD
SCHEMBL8439602 0.86 MRGPRX4 (0.45) MRGPRX4PPARD
SCHEMBL8304787 0.82 MAPT (0.41) MRGPRX4TDP2GRM2
SCHEMBL4613467 0.81 TDP2 (0.46) TDP2
SCHEMBL8300243 0.79 PTGES (0.41) TDP2HCRTR1HCRTR2
SCHEMBL8303862 0.78 PTGES (0.42) TDP2HCRTR1HCRTR2TRPM8
SCHEMBL8301702 0.77 MRGPRX4 (0.41) MRGPRX4PTGER1
SCHEMBL8300094 0.77 MRGPRX4 (0.43) MRGPRX4
SCHEMBL8299339 0.77 MRGPRX4 (0.43) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648752-B1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO (JP) 1999-10-06 EP disclosed
US-5700824-A Triazole derivatives, insecticide, acaricide and methods thereof KUMIAI CHEMICAL INDUSTRIAL CO. LTD. (JP) 1997-12-23 US disclosed
US-5616594-A Triazole derivatives, insecticide, acaricide and methods thereof IHARA CHEMICAL INDUSTRY CO. LTD. (JP) 1997-04-01 US disclosed
EP-0648752-A1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-19 EP disclosed