SCHEMBL25631007

SCHEMBL25631007

CC(C)CCC(C)N1CCN(C2CCC(C(=O)C(C)C)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 4/20 0.38
▸ OPRM1 P35372 3/20 0.38
▸ CYP2C19 P33261 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ KDM4E B2RXH2 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ SIGMAR1 Q99720 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.33
▸ CYP2C9 P11712 1/20 0.32

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
SCHEMBL26295710 0.82 HRH3 (0.43) CYP2C19CYP3A4KDM4EALDH1A1ALOX15
SCHEMBL24838146 0.79 HRH3 (0.41) CYP2C19CYP3A4KDM4EALDH1A1ALOX15
SCHEMBL25605133 0.79 HRH3 (0.41) CYP2C19CYP3A4KDM4EALDH1A1ALOX15
SCHEMBL25605129 0.79 HRH3 (0.41) CYP2C19CYP3A4KDM4EALDH1A1ALOX15
SCHEMBL25631008 0.79 HRH3 (0.40) CYP2C19KDM4EALDH1A1TP53CYP2C9
SCHEMBL25605834 0.79 HRH3 (0.40) CYP2C19KDM4EALDH1A1TP53CYP2C9
SCHEMBL25029130 0.77 FPR3 (0.36) OPRL1KDM4EALDH1A1ALOX15SIGMAR1
SCHEMBL26059633 0.77 FPR3 (0.36) OPRL1KDM4EALDH1A1ALOX15SIGMAR1
SCHEMBL25030230 0.77 FPR3 (0.36) OPRL1KDM4EALDH1A1ALOX15SIGMAR1
SCHEMBL25631005 0.75 KDM4E (0.52) CYP2C19KDM4EALDH1A1CYP2C9

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 4706/4885CYP2C19 3201/4885

“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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