SCHEMBL26892803

SCHEMBL26892803

CCC(C)OCC1CCCN1C

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42

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
SCHEMBL22062834 0.83 CHRNB4 (0.45) CHRNB4CHRNA3
SCHEMBL20028722 0.83 CHRNB4 (0.45) CHRNB4CHRNA3
SCHEMBL19165618 0.83 CHRNB4 (0.45) CHRNB4CHRNA3
SCHEMBL25907251 0.80 CHRNB4 (0.43) CHRNB4CHRNA3
SCHEMBL23979788 0.78 CHRNB4 (0.44) CHRNB4CHRNA3
SCHEMBL23023341 0.78 CYP1A2 (0.47) CHRNB4CHRNA3
SCHEMBL23979781 0.78 CHRNB4 (0.44) CHRNB4CHRNA3
SCHEMBL24730512 0.78 CYP1A2 (0.47) CHRNB4CHRNA3
SCHEMBL23979774 0.78 CHRNB4 (0.44) CHRNB4CHRNA3
SCHEMBL25808898 0.78 CYP1A2 (0.47) CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 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 (2 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-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS CHRNB4 4183/4885CHRNA3 4195/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS CHRNB4 4183/4885CHRNA3 4195/4885

“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.