SCHEMBL4771277

SCHEMBL4771277

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

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.34
KMT2A Q03164 4/20 0.34
NPC1 O15118 2/20 0.34
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
LMNA P02545 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 2/20 0.33
KIFC1 Q9BW19 1/20 0.33
MEN1 O00255 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 4/20 0.32
NPSR1 Q6W5P4 2/20 0.32
PAX8 Q06710 1/20 0.32
CDC7 O00311 1/20 0.31
DBF4 Q9UBU7 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL4763548 0.86 ALDH1A1 (0.36) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4767663 0.83 RAB9A (0.38) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4763093 0.82 KDM4E (0.41) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL2880226 0.77 NPC1 (0.53) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4769325 0.76 KMT2A (0.40) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4771392 0.76 ALDH1A1 (0.41) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4762382 0.75 RAB9A (0.44) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL5491169 0.74 RAB9A (0.34) RAB9AKMT2ANPC1ALDH1A1LMNA
SCHEMBL4771325 0.74 KMT2A (0.45) RAB9AKMT2ANPC1KDM4EALDH1A1
SCHEMBL4771254 0.74 NPC1 (0.39) RAB9AKMT2ANPC1KDM4EALDH1A1

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 RAB9A 838/4885KMT2A 770/4885NPC1 2528/4885

“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.