SCHEMBL26401405

SCHEMBL26401405

Cc1ccc(OCC(F)(F)C(F)F)cn1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ACACB O00763 1/20 0.41
CHRNB2 P17787 4/20 0.40
CHRNA4 P43681 4/20 0.40
ALDH1A1 P00352 1/20 0.40
CHRNB1 P11230 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNB3 Q05901 1/20 0.38
MAPK1 P28482 1/20 0.38
GRM5 P41594 1/20 0.38
CFTR P13569 3/20 0.38
MEN1 O00255 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL26401534 0.89 CHRNB2 (0.40) ACACBCHRNB2CHRNA4CHRNB1CHRNB4
SCHEMBL506299 0.82 CHRNB2 (0.42) KMT2ASMN1; SMN2CHRNB2CHRNA4ALDH1A1
SCHEMBL29706051 0.80 HTT (0.43) HTTKMT2ASMN1; SMN2ACACBALDH1A1
SCHEMBL15670386 0.80 HTT (0.43) HTTKMT2ASMN1; SMN2ACACBCHRNB2
SCHEMBL28749827 0.80 HTT (0.43) HTTKMT2ASMN1; SMN2ACACBALDH1A1
SCHEMBL21182267 0.79 CHRNB2 (0.40) KMT2ACHRNB2CHRNA4CHRNB1CHRNB4
SCHEMBL1710061 0.79 KMT2A (0.51) HTTKMT2ASMN1; SMN2ACACBALDH1A1
SCHEMBL21921098 0.78 CHRNB2 (0.39) KMT2ACHRNB2CHRNA4CHRNB1CHRNB4
SCHEMBL26401540 0.78 CHRNB2 (0.39) KMT2ACHRNB2CHRNA4CHRNB1CHRNB4
SCHEMBL15670383 0.78 HTT (0.44) HTTKMT2ASMN1; SMN2ACACBALDH1A1

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 HTT 2503/4885KMT2A 552/4885SMN1; SMN2 2926/4885

“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.