SCHEMBL25565449

SCHEMBL25565449

CN1C(=O)C2(CCOCC2)c2ccc(C(C)(C)C)cc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.40
OPRK1 P41145 5/20 0.40
OPRM1 P35372 5/20 0.40
OPRD1 P41143 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 1/20 0.35
EZH2 Q15910 1/20 0.35
PRKDC P78527 4/20 0.35
MAPT P10636 1/20 0.34
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
NR1H3 Q13133 1/20 0.33
CALCRL Q16602 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL25562919 0.84 NR1H3 (0.33) SMN1; SMN2ALDH1A1HTTPRKDCNR1H3
SCHEMBL25564780 0.82 OPRK1 (0.56) OPRL1OPRK1OPRM1OPRD1SMN1; SMN2
SCHEMBL21904166 0.81 OPRL1 (0.44) OPRL1OPRK1OPRM1OPRD1SMN1; SMN2
SCHEMBL21904556 0.81 OPRK1 (0.41) OPRL1OPRK1OPRM1OPRD1SMN1; SMN2
SCHEMBL17983437 0.77 OPRM1 (0.53) OPRL1OPRK1OPRM1SMN1; SMN2ALDH1A1
SCHEMBL14367669 0.75 MEN1 (0.39) ALDH1A1TP53POLBNR1H3
SCHEMBL24219918 0.74 BACE1 (0.38) OPRL1OPRK1OPRM1OPRD1EZH2
SCHEMBL23591212 0.74 SMN1; SMN2 (0.45) OPRL1OPRK1OPRM1OPRD1SMN1; SMN2
SCHEMBL21904416 0.74 CALCRL (0.44) OPRL1OPRK1OPRM1OPRD1ALDH1A1
SCHEMBL28372584 0.74 PRKDC (0.44) EZH2PRKDCCALCRL

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-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 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-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA OPRL1 2086/4885OPRK1 1292/4885OPRM1 1438/4885

“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.