SCHEMBL6370531

SCHEMBL6370531

Cc1c(F)c(F)cc(Oc2cccc(C(=O)Nc3ccc(F)cc3)n2)c1F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
GRM4 Q14833 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NPY5R Q15761 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
MCL1 Q07820 1/20 0.41

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
SCHEMBL7612230 0.80 MAPT (0.54) MAPTGRM4SMN1; SMN2NPC1RAB9A
SCHEMBL11247737 0.76 KMT2A (0.64) NPC1CYP1A2CYP2C19MEN1KMT2A
SCHEMBL8725049 0.75 MAPT (0.53) MAPTGRM4SMN1; SMN2NPC1RAB9A
SCHEMBL7612234 0.73 MAPT (0.56) MAPTGRM4SMN1; SMN2NPC1RAB9A
SCHEMBL9967267 0.73 MAPT (0.69) MAPTSMN1; SMN2NPC1RAB9ATP53
SCHEMBL9017227 0.72 MAPT (0.52) MAPTGRM4GAAMEN1KMT2A
SCHEMBL29732862 0.72 MAPT (0.65) MAPTRAB9AGAAKMT2AKDM4E
SCHEMBL54805 0.72 MAPT (0.65) MAPTRAB9AGAAKMT2AKDM4E
SCHEMBL29497315 0.72 MAPT (0.65) MAPTRAB9AGAAKMT2AKDM4E
SCHEMBL7606199 0.72 MAPT (0.55) MAPTGRM4GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050003963-A1 Herbicides containing substituted thien-3-yl-sulfonylamino(thio)carbonyl-triazolin(thi)one BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-01-06 US claimed

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-20050003963-A1 Herbicides containing substituted thien-3-yl-sulfonylamino(thio)carbonyl-triazolin(thi)one DDT, TARS2, CBR3 MAPT 3865/4885GRM4 1962/4885SMN1; SMN2 3715/4885

“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.