SCHEMBL4766951

SCHEMBL4766951

CC(CCOC(=O)c1cc(-c2ccccc2)nc(C)n1)=C(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 5/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 1/20 0.39
KMO O15229 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CCR6 P51684 1/20 0.38
HPGD P15428 3/20 0.37
HSD17B10 Q99714 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL4763339 0.82 ALDH1A1 (0.40) MAPTKDM4EALDH1A1L3MBTL1MEN1
SCHEMBL4767369 0.81 MEN1 (0.44) MAPTKDM4EALDH1A1L3MBTL1MEN1
SCHEMBL4769623 0.75 HDAC1 (0.47) MAPTKDM4EALDH1A1L3MBTL1MAPK1
SCHEMBL4767493 0.74 GRM5 (0.42)
SCHEMBL4763670 0.74 ESR1 (0.39) MAPTKDM4EALDH1A1L3MBTL1MAPK1
SCHEMBL4770435 0.74 SMN1; SMN2 (0.46) ALDH1A1L3MBTL1TDP1SMN1; SMN2RAB9A
SCHEMBL4767829 0.74 LDHA (0.50) MAPTMEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL4767563 0.72 LMNA (0.59) ALDH1A1KMT2AMAPK1TDP1SMN1; SMN2
SCHEMBL4767637 0.72 SMN1; SMN2 (0.54) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL28527128 0.72 KMO (0.65) MAPTKDM4EALDH1A1KMT2AGAA

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.