SCHEMBL26850294

SCHEMBL26850294

CCCCCCC(C)(CCCCCC)c1n[nH]cc1C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.33
CNR1 P21554 6/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ACAT1 P24752 1/20 0.31
SOAT1 P35610 1/20 0.31

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
SCHEMBL21720048 1.00 CNR2 (0.33) CNR2CNR1KDM4ETP53CYP3A4
SCHEMBL21719608 0.82 KDM4E (0.30) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL21719762 0.82 SMPD1 (0.30) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL21720049 0.82 CCNB2 (0.33) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL21719618 0.82 GGPS1 (0.33) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL21720043 0.81 KDM4E (0.40) CNR2CNR1KDM4ETP53CYP3A4
SCHEMBL21969698 0.81
SCHEMBL21884282 0.81 CNR1 (0.35) CNR2CNR1KDM4ETP53CYP3A4
SCHEMBL21885502 0.77 ALDH1A1 (0.32) CNR2CNR1KDM4ETSHR
SCHEMBL21718616 0.77 CNR2 (0.33) CNR2CNR1

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-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED 2023-11-30 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-20230382910-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN TRPV1, SCN3A, KCNN3 CNR2 187/4885CNR1 238/4885KDM4E 4346/4885

“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.