SCHEMBL4771237

SCHEMBL4771237

CC(CCOC(=O)c1ccc(OC(C)(C)C)nc1)=C(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.37
LMNA P02545 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 3/20 0.36
NNMT P40261 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
KDR P35968 2/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
PDE4B Q07343 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A2 P23975 1/20 0.32
TDP1 Q9NUW8 1/20 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
SCHEMBL4771199 0.87 MAPT (0.42) L3MBTL1LMNAMAPTNNMTPOLB
SCHEMBL4762510 0.85 MAPT (0.54) L3MBTL1LMNAMAPTPOLBPKM
SCHEMBL4770683 0.84 L3MBTL1 (0.56) L3MBTL1MAPTPOLB
SCHEMBL4767239 0.84 MAPT (0.43) L3MBTL1LMNAMAPTSMN1; SMN2RAB9A
SCHEMBL4762081 0.83 ACACB (0.39) L3MBTL1LMNAMAPTPOLBPKM
SCHEMBL4763551 0.83 L3MBTL1 (0.46) L3MBTL1LMNAMAPTSMN1; SMN2RAB9A
SCHEMBL4771394 0.82 LMNA (0.46) L3MBTL1LMNAMAPTSMN1; SMN2RAB9A
SCHEMBL4767243 0.81 LMNA (0.48) L3MBTL1LMNAMAPTRAB9AALDH1A1
SCHEMBL4762374 0.81 GRN (0.45) LMNAMAPTRAB9ACHRNB2CHRNA7
SCHEMBL4770536 0.81 LMNA (0.48) L3MBTL1LMNAMAPTRAB9AALDH1A1

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 L3MBTL1 17/4885LMNA 4259/4885GAA 3408/4885

“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.