SCHEMBL4769017

SCHEMBL4769017

CC(CCCCOC(=O)c1cnc(C#N)nc1C)=C(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.36
HSD17B10 Q99714 6/20 0.36
ALDH1A1 P00352 9/20 0.35
MAPT P10636 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 2/20 0.34
GLA P06280 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ALOX15 P16050 1/20 0.33
NPC1 O15118 2/20 0.33
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
PKM P14618 1/20 0.32
TSHR P16473 2/20 0.32

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
SCHEMBL4762389 0.81 NPC1 (0.41) KDM4EHSD17B10ALDH1A1MAPTL3MBTL1
SCHEMBL4763396 0.81 HPGD (0.48) KDM4EHSD17B10ALDH1A1MAPTHPGD
SCHEMBL4768992 0.81 NPC1 (0.40) KDM4EHSD17B10ALDH1A1MAPTHPGD
SCHEMBL4772620 0.81 ALDH1A1 (0.43) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL4763186 0.80 TSHR (0.36) KDM4EHSD17B10ALDH1A1MAPTL3MBTL1
SCHEMBL4765268 0.80 TSHR (0.40) KDM4EHSD17B10ALDH1A1MAPTL3MBTL1
SCHEMBL4770547 0.79 RAB9A (0.33) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL4765479 0.79 LMNA (0.36) KDM4EHSD17B10ALDH1A1MAPTL3MBTL1
SCHEMBL4767541 0.79 FOS (0.40) KDM4EHSD17B10ALDH1A1MAPTRAB9A
SCHEMBL4765991 0.78 ALDH1A1 (0.51) KDM4EHSD17B10ALDH1A1MAPTL3MBTL1

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 KDM4E 1056/4885HSD17B10 3616/4885ALDH1A1 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.