SCHEMBL25630790

SCHEMBL25630790

CC(C)C(=O)N1CCC(N2CCC([C@H]3CC[C@@H](C(C)C)CC3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 15/20 0.40
▸ OPRM1 P35372 13/20 0.40
▸ OPRK1 P41145 7/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ OPRD1 P41143 4/20 0.39
▸ MBTD1 Q05BQ5 1/20 0.38
▸ L3MBTL3 Q96JM7 1/20 0.38
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ ACACB O00763 1/20 0.36
▸ ACACA Q13085 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
SCHEMBL25605581 1.00 OPRL1 (0.40) OPRL1OPRM1OPRK1CHRM2CHRM1
SCHEMBL24838380 0.91 CHRM1 (0.43) OPRL1OPRM1OPRK1CHRM2CHRM1
SCHEMBL25605709 0.91 CHRM1 (0.43) OPRL1OPRM1OPRK1CHRM2CHRM1
SCHEMBL25604713 0.85 OPRL1 (0.41) OPRL1OPRM1OPRK1CHRM2CHRM1
SCHEMBL25630791 0.83 CHRM1 (0.41) OPRL1OPRM1OPRK1CHRM2CHRM1
SCHEMBL25605587 0.82 EPHX2 (0.45) CHRM2CHRM1MBTD1L3MBTL3CYP3A4
SCHEMBL24838461 0.82 LMNA (0.47) OPRL1OPRM1CHRM2CHRM1CYP3A4
SCHEMBL25600507 0.82 OPRL1 (0.34) OPRL1OPRM1OPRK1OPRD1
SCHEMBL25600504 0.82 OPRL1 (0.34) OPRL1OPRM1OPRK1OPRD1
SCHEMBL25107536 0.82 MEN1 (0.46) CHRM2CHRM1MBTD1L3MBTL3CYP3A4

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-20230173078-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 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-20230173078-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCA2, SMARCC2 OPRL1 4834/4885OPRM1 4706/4885OPRK1 4654/4885

“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.

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