SCHEMBL20074403

SCHEMBL20074403

CCC(CC)C(C)CN(C)C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 1/20 0.36
OPRM1 P35372 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
SCHEMBL15314156 0.86 SLC22A1 (0.32) SLC22A1OPRM1
SCHEMBL24324108 0.86 SLC22A1 (0.32) SLC22A1OPRM1
SCHEMBL19072799 0.85 SLC22A1 (0.37) SLC22A1OPRM1
SCHEMBL19243166 0.85 SLC22A1 (0.37) SLC22A1OPRM1
SCHEMBL25600030 0.81 SLC22A1 (0.31) SLC22A1OPRM1
SCHEMBL8756248 0.78 SLC22A1 (0.34) SLC22A1OPRM1
SCHEMBL22018608 0.78 PIK3CD (0.30)
SCHEMBL11794150 0.78 HTR2A (0.32)
SCHEMBL16079215 0.78 SLC22A1 (0.33) SLC22A1OPRM1
SCHEMBL24850079 0.77 ALDH1A1 (0.30)

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
EP-4261828-A2 METHODS AND PROCESSES FOR NON-INVASIVE ASSESSMENT OF GENETIC VARIATIONS Sequenom, Inc. (US) 2023-10-18 EP disclosed
US-20180105533-A1 BILE ACID RECEPTOR MODULATORS AND METHODS OF USE THEREOF CITY OF HOPE 2018-04-19 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-20180105533-A1 BILE ACID RECEPTOR MODULATORS AND METHODS OF USE THEREOF NR1H4, GPBAR1, SLC10A2 SLC22A1 1245/4885OPRM1 495/4885

“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.