SCHEMBL4762227

SCHEMBL4762227

CC(CCOC(=O)c1sc(-c2ccc(N(C)C)cc2)nc1C)=C(F)F

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.49
DBF4 Q9UBU7 4/20 0.49
RAB9A P51151 4/20 0.42
TRPM8 Q7Z2W7 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 4/20 0.41
GAA P10253 3/20 0.41
MAPT P10636 3/20 0.40
HSP90AA1 P07900 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
TARBP2 Q15633 1/20 0.39

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
SCHEMBL4767473 0.91 CDC7 (0.48) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4772749 0.87 CDC7 (0.51) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4767637 0.87 SMN1; SMN2 (0.54) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4769034 0.85 MAPT (0.58) CDC7DBF4RAB9AMEN1KMT2A
Dimethylamine SCHEMBL4762229 0.85 SMN1; SMN2 (0.53) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4771024 0.84 CDC7 (0.48) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4764983 0.83 RAB9A (0.58) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4767765 0.80 RAB9A (0.55) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4768906 0.80 CDC7 (0.48) CDC7DBF4RAB9ATRPM8MEN1
SCHEMBL4767289 0.80 SMN1; SMN2 (0.51) CDC7DBF4RAB9ATRPM8MEN1

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 CDC7 2900/4885DBF4 822/4885RAB9A 838/4885

“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.