SCHEMBL4762228

SCHEMBL4762228

CC(CCOC(=O)c1ccc2nccnc2c1)=C(F)F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
HTT P42858 4/20 0.45
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
POLB P06746 4/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
AHR P35869 1/20 0.39
HPGD P15428 3/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.38
RECQL P46063 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
SCHEMBL10746855 0.77 MAPT (0.62) MAPTALDH1A1HTTRAB9ANPC1
SCHEMBL29159358 0.75 MAPT (0.58) MAPTALDH1A1HTTRAB9ANPC1
SCHEMBL4767258 0.75 MAPT (0.45) MAPTALDH1A1RAB9ANPC1MEN1
SCHEMBL4771199 0.75 MAPT (0.42) MAPTRAB9APOLBL3MBTL1LMNA
SCHEMBL4767563 0.74 LMNA (0.59) ALDH1A1RAB9ANPC1KMT2ASMN1; SMN2
SCHEMBL4762510 0.73 MAPT (0.54) MAPTALDH1A1RAB9APOLBL3MBTL1
SCHEMBL4764986 0.72 CTNNB1 (0.46) ALDH1A1MEN1KMT2AGAA
SCHEMBL4763346 0.72 HDAC1 (0.38) ALDH1A1RAB9ANPC1MEN1KMT2A
SCHEMBL4767239 0.72 MAPT (0.43) MAPTALDH1A1RAB9ANPC1L3MBTL1
SCHEMBL31167563 0.72 HTT (0.66) MAPTALDH1A1HTTRAB9ANPC1

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 4388/4885ALDH1A1 875/4885HTT 4141/4885

“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.