SCHEMBL26401534

SCHEMBL26401534

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

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.40
CHRNA4 P43681 4/20 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
GRM5 P41594 1/20 0.38
CYP17A1 P05093 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ACACB O00763 1/20 0.36

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
SCHEMBL26401405 0.89 HTT (0.43) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL506299 0.81 CHRNB2 (0.42) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL21182267 0.78 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL21921098 0.77 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL26401540 0.77 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL13020439 0.75 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL20231023 0.75 CHRNB2 (0.38) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL20089414 0.73 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL20037956 0.73 CHRNB2 (0.41) CHRNB2CHRNA4CHRNB1CHRNB4CHRNA3
SCHEMBL2608829 0.72 CHRNB2 (0.45) CHRNB2CHRNA4

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 CHRNB2 1172/4885CHRNA4 328/4885CHRNB1 889/4885

“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.