SCHEMBL25007404

SCHEMBL25007404

CCCC(C)CCNCC(CCC)CCC

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL17088076 0.84 TSHR (0.39) TSHRALDH1A1
SCHEMBL5932513 0.83 TSHR (0.46) TSHRALDH1A1
SCHEMBL25005536 0.82 TSHR (0.42) TSHRALDH1A1CYP3A4
SCHEMBL21158696 0.80 ALDH1A1 (0.42) TSHRALDH1A1CYP3A4
SCHEMBL18388567 0.78 TSHR (0.42) TSHRALDH1A1
SCHEMBL21754098 0.78 TSHR (0.43) TSHR
SCHEMBL20629301 0.78 TSHR (0.43) TSHR
SCHEMBL17919014 0.78 TSHR (0.42) TSHRALDH1A1
SCHEMBL7100023 0.78 TSHR (0.43) TSHR
SCHEMBL8125049 0.78 TSHR (0.42) TSHRALDH1A1

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-20230038512-A1 CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-02-09 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-20230038512-A1 CRBN LIGANDS AND USES THEREOF CRBN, CRKL, ERBB3 TSHR 2599/4885ALDH1A1 4145/4885CYP3A4 4566/4885

“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.