SCHEMBL25489339

SCHEMBL25489339

CC(C)C1CCCN(C2CCCCC2)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.36
DPP4 P27487 1/20 0.36
ALDH1A1 P00352 1/20 0.35
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
OPRK1 P41145 1/20 0.35
KDM2B Q8NHM5 3/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM3 P20309 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL24494860 1.00 SIGMAR1 (0.36) SIGMAR1DPP4ALDH1A1OPRM1OPRL1
SCHEMBL14519149 0.98 ALDH1A1 (0.36) SIGMAR1DPP4ALDH1A1OPRM1OPRL1
SCHEMBL20757013 0.94 ALDH1A1 (0.36) ALDH1A1OPRM1OPRL1OPRK1KDM2B
SCHEMBL14519158 0.94 MEN1 (0.38) SIGMAR1DPP4ALDH1A1OPRM1OPRL1
SCHEMBL20756943 0.92 MEN1 (0.37) SIGMAR1DPP4ALDH1A1OPRM1OPRL1
SCHEMBL20858038 0.92 ALDH1A1 (0.37) ALDH1A1OPRM1OPRL1OPRK1MEN1
SCHEMBL25489283 0.90 OPRM1 (0.39) ALDH1A1OPRM1OPRL1OPRK1MEN1
SCHEMBL25481370 0.90 OPRL1 (0.39) DPP4ALDH1A1OPRM1OPRL1OPRK1
SCHEMBL27290705 0.90 DPP4 (0.44) SIGMAR1DPP4OPRM1OPRL1OPRK1
SCHEMBL26796817 0.88 OPRL1 (0.41) SIGMAR1DPP4OPRM1OPRL1OPRK1

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-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-05-30 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-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 SIGMAR1 3349/4885DPP4 1075/4885ALDH1A1 1652/4885

“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.