SCHEMBL8304433

SCHEMBL8304433

Cn1nc(-c2c(F)cccc2Cl)nc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.51
CRHR1 P34998 6/20 0.48
TNKS O95271 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
PDE2A O00408 1/20 0.38
PDE10A Q9Y233 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
PTGES O14684 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
DPP4 P27487 1/20 0.37

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
SCHEMBL5727614 0.87 HSD11B1 (0.40) HSD11B1CRHR1TNKSNR1H2NR1H3
SCHEMBL8876219 0.86 CRHR1 (0.40) HSD11B1CRHR1PDE2APDE10AKMT2A
SCHEMBL8300288 0.85 CRHR1 (0.37) HSD11B1CRHR1LMNAPDE2APDE10A
SCHEMBL8878103 0.84 CRHR1 (0.41) HSD11B1CRHR1LMNAHTTPDE2A
SCHEMBL5727058 0.84 HSD11B1 (0.36) HSD11B1CRHR1NR1H2NR1H3PDE2A
SCHEMBL5727128 0.84 HSD11B1 (0.36) HSD11B1CRHR1NR1H2NR1H3PDE2A
SCHEMBL5726771 0.84 HSD11B1 (0.36) HSD11B1CRHR1NR1H2NR1H3PDE2A
SCHEMBL8303712 0.83 PDE2A (0.38) HSD11B1CRHR1NR1H2NR1H3LMNA
SCHEMBL8875200 0.83 F7 (0.38) HSD11B1LMNAKMT2AMEN1ALDH1A1
SCHEMBL8875632 0.82 HSD11B1 (0.39) HSD11B1CRHR1PDE2APTGES

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