SCHEMBL720845

SCHEMBL720845

C=Cc1c(N)nc(-c2ccc(F)c(OC)c2)nc1C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
ADORA3 P0DMS8 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
GRK6 P43250 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HTT P42858 1/20 0.36
NEK2 P51955 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.36
PKM P14618 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGS2 P35354 1/20 0.36
GRM4 Q14833 1/20 0.35
CHEK1 O14757 1/20 0.35
CHEK2 O96017 1/20 0.35

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
SCHEMBL719542 0.90 ERN1 (0.39) MAPTALDH1A1HPGDHSD17B10KDM4E
SCHEMBL721639 0.88 KDM4E (0.42) MAPTMAPK1ADORA3ALDH1A1HPGD
SCHEMBL716684 0.88 KDM4E (0.36) MAPK1ALDH1A1HPGDHSD17B10NEK2
SCHEMBL716661 0.87 KDM4E (0.43) MAPTALDH1A1KMT2AKDM4EPKM
SCHEMBL719097 0.86 KDM4E (0.42) MAPTALDH1A1KMT2AKDM4EPKM
SCHEMBL718383 0.85 LMNA (0.41) MAPTMAPK1ADORA3ALDH1A1HTT
SCHEMBL720168 0.85 MPL (0.39) MAPT
SCHEMBL16036298 0.84 KIF11 (0.42)
SCHEMBL29556077 0.84 KIF11 (0.42)
SCHEMBL719273 0.84 ERN1 (0.35) ALDH1A1HPGDHSD17B10KDM4EPKM

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-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-01 US disclosed
US-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-01 US disclosed
US-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-01 US disclosed
WO-2010092339-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2010-08-19 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-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES DPYD, DHODH, TYMP MAPT 2842/4885MAPK1 1922/4885ADORA3 445/4885

“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.