SCHEMBL9026017

SCHEMBL9026017

CCCCCCCCc1ccc(-c2nc(-c3c(F)cccc3Cl)nn2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.49
NR1H2 P55055 2/20 0.40
NR1H3 Q13133 2/20 0.40
SPNS2 Q8IVW8 2/20 0.39
RARB P10826 4/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RARA P10276 1/20 0.37
RARG P13631 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
SCHEMBL9577157 0.96 HSD11B1 (0.46) HSD11B1NR1H2NR1H3RAB9AKMT2A
SCHEMBL8874472 0.87 HSD11B1 (0.40) HSD11B1RARBCNR1CNR2MEN1
SCHEMBL8875250 0.87 HSD11B1 (0.42) HSD11B1RARBMEN1KMT2ASMN1; SMN2
SCHEMBL8877431 0.87 HSD11B1 (0.40) HSD11B1RARBCNR1CNR2MEN1
SCHEMBL9027243 0.82 HSD11B1 (0.65) HSD11B1NR1H2NR1H3SPNS2CNR1
SCHEMBL9028200 0.82 HSD11B1 (0.65) HSD11B1NR1H2NR1H3SPNS2CNR1
SCHEMBL9026732 0.82 HSD11B1 (0.65) HSD11B1NR1H2NR1H3SPNS2CNR1
SCHEMBL8875632 0.82 HSD11B1 (0.39) HSD11B1
SCHEMBL8942725 0.81 NR1H2 (0.49) NR1H2NR1H3RAB9AKDM4EMEN1
SCHEMBL8874361 0.80 RORC (0.38) NR1H2NR1H3ALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6234751-A None JP disclosed
EP-0572142-B1 Novel 3,5-diphenyl substituted 1,2,4-triazoles and their use as insecticides and acaricides KUMIAI CHEMICAL INDUSTRY CO (JP) 1996-07-31 EP disclosed
JP-H06234751-A TRIAZOLE DERIVATIVE AND INSECTICIDE AND ACARICIDE KUMIAI CHEM IND CO LTD 1994-08-23 JP disclosed
US-5318959-A A new miticides diaryl alkyl 1,2,4-triazoles KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1994-06-07 US disclosed
EP-0572142-A2 Novel 3,5-diphenyl substituted 1,2,4-triazoles and their use as insecticides and acaricides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1993-12-01 EP disclosed