SCHEMBL2134013

SCHEMBL2134013

COC(=O)c1nc(Cl)cc(NCc2ccc(C(F)(F)F)nc2)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.49
KCNQ2 O43526 1/20 0.49
KCNQ4 P56696 1/20 0.49
KCNQ5 Q9NR82 1/20 0.49
CNR1 P21554 2/20 0.42
ADORA2A P29274 1/20 0.42
CSF1R P07333 3/20 0.39
KIT P10721 2/20 0.39
CNR2 P34972 1/20 0.39
LCK P06239 1/20 0.39
PGR P06401 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
PDGFRB P09619 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
PDGFRA P16234 1/20 0.39
FLT1 P17948 1/20 0.39
DRD1 P21728 1/20 0.39

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
SCHEMBL10206279 0.86 KDM4E (0.43) KCNQ3KCNQ2KCNQ4KCNQ5ALDH1A1
SCHEMBL2133084 0.82 MEN1 (0.47) CNR1TBXA2RALDH1A1MAPTVNN1
SCHEMBL2135021 0.79 CA1 (0.47) ALDH1A1KDM4EGAASMN1; SMN2CYP3A4
SCHEMBL2136286 0.79 SMN1; SMN2 (0.47) ALDH1A1KDM4EGAASMN1; SMN2MAPT
SCHEMBL2137567 0.78 KMT2A (0.47) FLT1KDRALDH1A1KDM4ESMN1; SMN2
SCHEMBL2139093 0.77 ABL1 (0.51) CNR1CNR2AURKBALDH1A1KDM4E
SCHEMBL2137037 0.77 ADORA2B (0.43) ADORA2AAURKBKDM4EGAAMAPT
SCHEMBL12737919 0.77 PDE10A (0.50) KCNQ3KCNQ2KCNQ4KCNQ5CNR1
SCHEMBL13437412 0.75 CYP2C9 (0.50) KCNQ3KCNQ2KCNQ4KCNQ5CNR1
SCHEMBL28783414 0.75 VNN1 (0.52) KCNQ3KCNQ2KCNQ4KCNQ5VNN1

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-2445884-B1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LTD (GB) 2013-02-13 EP disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
WO-2010149956-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2010-12-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES DDT, DAO, NPM1 KCNQ3 2247/4885KCNQ2 2164/4885KCNQ4 1950/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.