SCHEMBL26401320

SCHEMBL26401320

CCS(=O)(=O)C(CC=O)C(=O)c1ccc(OCC(C)(F)F)cn1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 4/20 0.35
▸ CACNA1I Q9P0X4 2/20 0.31
▸ CACNA1G O43497 1/20 0.31
▸ CACNA1H O95180 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ DGAT1 O75907 2/20 0.31
▸ P4HTM Q9NXG6 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
SCHEMBL22932409 0.90 BACE1 (0.35) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL26401362 0.82 ACACB (0.37) ACACBCACNA1ICACNA1GCACNA1HCNR2
SCHEMBL19767100 0.73 ACACB (0.37) ACACBCACNA1ICACNA1GCACNA1HCNR2
SCHEMBL21078914 0.73 P4HTM (0.41) ACACBCACNA1ICACNA1GCACNA1HCNR2
SCHEMBL19767082 0.72 ACACB (0.32) ACACBCACNA1ICACNA1GCACNA1HCNR2
SCHEMBL22932412 0.72 BACE1 (0.40) CACNA1ICACNA1GCACNA1HCNR2KCNH2
SCHEMBL26401378 0.70 CYP11B1 (0.36) ACACBP4HTM
SCHEMBL17992215 0.65 BACE1 (0.39) ACACB
SCHEMBL17992211 0.64 BACE1 (0.37) CNR2P4HTM
SCHEMBL17992189 0.64 KMT2A (0.41) ACACBCACNA1ICACNA1GCACNA1HCNR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-10 — — US 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-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same C5, PRXL2A, NOX3 ACACB 2404/4885CACNA1I 4192/4885CACNA1G 3760/4885

“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.

Send feedback