SCHEMBL17200653

SCHEMBL17200653

Cc1cc(F)c(Nc2c(-c3ccc(F)cc3Br)c(C)nn2C)c(Br)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
KDM4E B2RXH2 1/20 0.35
GALR3 O60755 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC34A1 Q06495 4/20 0.33
NMT1 P30419 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL17200646 0.95 MAPT (0.36) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL17200664 0.93 SLC34A1 (0.37) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL170510 0.93 MAPT (0.36) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL17200658 0.90 HSD11B1 (0.36) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL17200645 0.90 MAPT (0.36) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL175788 0.90 MAPT (0.37) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL170832 0.88 SLC34A1 (0.38) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL173411 0.87 SLC34A1 (0.38) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL17200650 0.86 MAPT (0.38) MAPTKDM4EGALR3HTTSMN1; SMN2
SCHEMBL29367616 0.86 MAPT (0.35) MAPTKDM4EGALR3HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464056-B2 Fungicidal 4-methylanilino pyrazoles E I DU PONT DE NEMOURS AND COMPANY (US) 2016-10-11 US claimed
EP-2864293-B1 FUNGICIDAL 4-METHYLANILINO PYRAZOLES DU PONT (US) 2016-04-27 EP claimed
US-20150307456-A1 FUNGICIDAL 4-METHYLANILINO PYRAZOLES FMC CORPORATION 2015-10-29 US claimed
US-9464056-B2 Fungicidal 4-methylanilino pyrazoles E I DU PONT DE NEMOURS AND COMPANY (US) 2016-10-11 US disclosed
EP-2864293-B1 FUNGICIDAL 4-METHYLANILINO PYRAZOLES DU PONT (US) 2016-04-27 EP disclosed
US-20150307456-A1 FUNGICIDAL 4-METHYLANILINO PYRAZOLES FMC CORPORATION 2015-10-29 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-20150307456-A1 FUNGICIDAL 4-METHYLANILINO PYRAZOLES CYP2F1, CYP1B1, CYP4B1 MAPT 4790/4885KDM4E 1163/4885GALR3 1999/4885

“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.