SCHEMBL4763364

SCHEMBL4763364

CC(CCOC(=O)c1cnc(-c2ccccc2)nc1)=C(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPK1 P28482 2/20 0.42
ATM Q13315 1/20 0.42
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 1/20 0.41
HPGDS O60760 1/20 0.41
CNR2 P34972 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 4/20 0.38
KDM4E B2RXH2 4/20 0.38
GAA P10253 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
SCHEMBL4767829 0.86 LDHA (0.50) MAPTLMNASMN1; SMN2RAB9ANPC1
SCHEMBL4763270 0.83 ALDH1A1 (0.54) ALDH1A1MAPTLMNASMN1; SMN2MAPK1
SCHEMBL4767563 0.83 LMNA (0.59) ALDH1A1LMNASMN1; SMN2MAPK1RAB9A
SCHEMBL4767380 0.81 ALDH1A1 (0.52) ALDH1A1MAPTLMNASMN1; SMN2MAPK1
SCHEMBL4762374 0.79 GRN (0.45) MAPTLMNARAB9AHPGDS
SCHEMBL4763338 0.79 MAPT (0.45) ALDH1A1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL4768796 0.78 HRH3 (0.38) ALDH1A1MAPTLMNATDP1POLB
SCHEMBL4769471 0.78 CDC7 (0.52) ALDH1A1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL4767324 0.77 RXRA (0.40) ALDH1A1MAPTLMNASMN1; SMN2MAPK1
SCHEMBL4771199 0.77 MAPT (0.42) MAPTLMNARAB9APOLBL3MBTL1

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 ALDH1A1 875/4885MAPT 4388/4885LMNA 4259/4885

“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.