SCHEMBL16019392

SCHEMBL16019392

CC(C)(C)C(C)(C)c1cccn(-c2cccc(Cl)c2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.40
POLB P06746 1/20 0.40
MGLL Q99685 1/20 0.39
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 3/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
HCAR1 Q9BXC0 1/20 0.37
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
CYP1A2 P05177 1/20 0.36
ADRB1 P08588 1/20 0.36
CYP3A4 P08684 1/20 0.36
HTR1A P08908 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL16019397 0.84 L3MBTL1 (0.42) THRBPOLBMGLLKMT2AGAA
SCHEMBL16019404 0.84 MGLL (0.45) POLBMGLLKMT2AKDM4EGAA
SCHEMBL16019401 0.82 HTT (0.47) MAPTTP53LMNAPKMRXFP1
SCHEMBL16019389 0.81 NSD2 (0.42)
SCHEMBL16019396 0.80 ALDH1A1 (0.53) POLBKMT2AKDM4EGAAMAPT
SCHEMBL8140296 0.71 NOTUM (0.47) THRBPOLBMGLLKMT2AKDM4E
SCHEMBL19398118 0.69 ATM (0.43) POLBKMT2AKDM4EMAPTMEN1
SCHEMBL15328279 0.69 MAPK1 (0.55) THRBPOLBKMT2AKDM4EGAA
SCHEMBL2222230 0.69 MGLL (0.50) THRBPOLBMGLLKMT2AMEN1
SCHEMBL2542214 0.67 MGLL (0.44) THRBMGLLKMT2AMEN1TP53

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
US-9693556-B2 Herbicidal pyridazinone derivatives SYNGENTA LIMITED (GB) 2017-07-04 US disclosed
US-9693556-B2 Herbicidal pyridazinone derivatives SYNGENTA LIMITED (GB) 2017-07-04 US disclosed
US-20140256546-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA LIMITED (GB) 2014-09-11 US disclosed
US-20140256546-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES SYNGENTA LIMITED (GB) 2014-09-11 US 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-20140256546-A1 HERBICIDAL PYRIDAZINONE DERIVATIVES PRDX6, PRDX1, CBR3 THRB 2625/4885POLB 4633/4885MGLL 3816/4885

“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.