SCHEMBL18952901

SCHEMBL18952901

Fc1cc(-c2ccc(Cl)cc2)ccc1-c1n[c]cs1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.34
BCHE P06276 2/20 0.33
EIF4E P06730 2/20 0.33
DHODH Q02127 1/20 0.32
ALOX5 P09917 1/20 0.32
AR P10275 1/20 0.32
PDK2 Q15119 1/20 0.31
HSD11B1 P28845 2/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP2 O95551 2/20 0.31
NOTUM Q6P988 1/20 0.30
AHR P35869 1/20 0.30

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
SCHEMBL2753663 0.78 HDAC3 (0.35) EIF4EALDH1A1KMT2A
SCHEMBL208797 0.77 GFER (0.42) ALDH1A1KMT2ANOTUM
SCHEMBL2750624 0.76 RAB9A (0.38) ALDH1A1KMT2ANOTUM
SCHEMBL8649872 0.75 EPHB4 (0.40) BCHE
SCHEMBL18952631 0.75 CYP1A1 (0.39) APEX1BCHEHSD11B1
SCHEMBL694300 0.74 RAB9A (0.47) HSD11B1ALDH1A1KMT2AAHR
SCHEMBL18952679 0.73 EIF4E (0.40) APEX1BCHEEIF4EDHODHAR
SCHEMBL2894960 0.72 HSD11B1 (0.39) PDK2HSD11B1
SCHEMBL2752772 0.71 ALDH1A1 (0.40) EIF4EALDH1A1
SCHEMBL14562911 0.71 NPC1 (0.39) ALOX5KMT2A

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-3386973-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES Syngenta Participations AG (CH) 2018-10-17 EP disclosed
WO-2017097927-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-15 WO disclosed