SCHEMBL4763370

SCHEMBL4763370

CC(CCOC(=O)c1sc(Nc2ccc(C)cc2)nc1C)=C(F)F

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.60
LMNA P02545 3/20 0.60
ALDH1A1 P00352 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.58
DHODH Q02127 6/20 0.57
MAPT P10636 5/20 0.57
NPSR1 Q6W5P4 2/20 0.57
NPC1 O15118 3/20 0.57
HPGD P15428 3/20 0.57
RAB9A P51151 3/20 0.57
GAA P10253 1/20 0.47
MEN1 O00255 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
KMT2A Q03164 1/20 0.47
RELA Q04206 1/20 0.47
ADORA3 P0DMS8 1/20 0.46
KIFC1 Q9BW19 1/20 0.45

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
SCHEMBL4762386 0.92 MAPT (0.60) KDM4ELMNAALDH1A1SMN1; SMN2DHODH
SCHEMBL4763261 0.91 MAPT (0.69) KDM4ELMNAALDH1A1SMN1; SMN2DHODH
SCHEMBL4763532 0.82 MAPT (0.54) KDM4ELMNAALDH1A1SMN1; SMN2DHODH
SCHEMBL4763613 0.81 MAPT (0.68) KDM4ELMNAALDH1A1SMN1; SMN2DHODH
SCHEMBL4767663 0.77 RAB9A (0.38) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL4767442 0.77 NPC1 (0.48) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL4771024 0.77 CDC7 (0.48) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL4763093 0.76 KDM4E (0.41) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL27971173 0.76 SMN1; SMN2 (0.97) KDM4ELMNAALDH1A1SMN1; SMN2DHODH
SCHEMBL18320945 0.76 KDM4E (1.00) KDM4ELMNAALDH1A1SMN1; SMN2DHODH

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 1056/4885LMNA 4259/4885ALDH1A1 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.