SCHEMBL4763532

SCHEMBL4763532

CC(CCOC(=O)c1sc(Nc2cccc(C(F)(F)F)c2)nc1C)=C(F)F

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.54
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 4/20 0.54
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52
HPGD P15428 2/20 0.52
DHODH Q02127 9/20 0.50
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 2/20 0.45

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
SCHEMBL4763261 0.86 MAPT (0.69) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL12158128 0.86 MAPT (0.71) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4763370 0.82 KDM4E (0.60) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4762386 0.81 MAPT (0.60) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4771178 0.79 RXRA (0.42) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL12158138 0.77 DHODH (0.60) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4763613 0.77 MAPT (0.68) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL4769034 0.75 MAPT (0.58) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL12158164 0.75 DHODH (0.56) MAPTKDM4EALDH1A1RAB9ANPC1
SCHEMBL12158135 0.74 DHODH (0.69) MAPTKDM4EALDH1A1RAB9ANPC1

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-1439169-B1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO (JP) 2008-08-06 EP disclosed
US-7273878-B2 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-09-25 US disclosed
US-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2004-12-09 US disclosed
EP-1439169-A1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2004-07-21 EP 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-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor DDT, WEE1, NOTUM MAPT 4388/4885KDM4E 1056/4885ALDH1A1 875/4885

“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.