SCHEMBL25633435

SCHEMBL25633435

CC(C)CC(CC(C)(C)N)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL20992587 0.75
SCHEMBL24355379 0.74 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1CYP1A2CYP3A4
SCHEMBL19734122 0.73 CYP1A2 (0.31) CYP1A2CYP3A4CYP2C9HIF1A
SCHEMBL20626548 0.72
SCHEMBL905769 0.72
SCHEMBL9989406 0.71 TSHR (0.41) ALDH1A1TSHRMAPK1CYP3A4
SCHEMBL29249254 0.69
SCHEMBL29249245 0.69
Hydrochloric Acid SCHEMBL21879614 0.69
SCHEMBL16572906 0.68 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1CYP1A2CYP3A4

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-20230173093-A1 CHARGE VARIANT LINKERS SEAGEN INC (US) 2023-06-08 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-20230173093-A1 CHARGE VARIANT LINKERS SSB, UACA, CDA ALDH1A1 1439/4885TSHR 1706/4885MAPK1 4444/4885

“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.