SCHEMBL4767355

SCHEMBL4767355

CC(CCCCSC(=O)c1ccc(Cl)nc1)=C(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.42
DGAT1 O75907 2/20 0.40
RAB9A P51151 5/20 0.38
MAPT P10636 2/20 0.38
PKM P14618 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
GRM4 Q14833 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
IDO1 P14902 1/20 0.35
TSHR P16473 1/20 0.35
KCNQ3 O43525 1/20 0.35
KCNQ2 O43526 1/20 0.35
KCNE1 P15382 1/20 0.35
KCNQ1 P51787 1/20 0.35

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
SCHEMBL4763371 0.79 L3MBTL1 (0.54) DGAT1RAB9AMAPTPKMSMN1; SMN2
SCHEMBL11919872 0.67 DGAT1 (0.65) NAPRTDGAT1RAB9AMAPTPKM
SCHEMBL29592337 0.67 NAPRT (0.67) NAPRTDGAT1RAB9AMAPTPKM
SCHEMBL213163 0.67 NAPRT (0.67) NAPRTDGAT1RAB9AMAPTPKM
SCHEMBL10575120 0.67 NAPRT (0.67) NAPRTDGAT1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL2271956 0.66 HSD17B3 (0.56) NAPRTDGAT1RAB9AMAPTL3MBTL1
SCHEMBL3299695 0.65 NAPRT (0.55) NAPRTDGAT1RAB9AMAPTPKM
SCHEMBL1985578 0.65 NAPRT (0.64) NAPRTDGAT1RAB9AMAPTPKM
SCHEMBL2270818 0.65 HSD17B3 (0.57) NAPRTDGAT1RAB9AMAPTL3MBTL1
SCHEMBL20372049 0.64 HSD17B3 (0.54) NAPRTDGAT1RAB9AMAPTPKM

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 NAPRT 3730/4885DGAT1 1111/4885RAB9A 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.