SCHEMBL25631008

SCHEMBL25631008

CC(C)CCC(=O)N1CCN([C@H]2CC[C@@H](C(=O)C(C)C)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 7/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ TP53 P04637 1/20 0.35

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
SCHEMBL25605834 1.00 HRH3 (0.40) HRH3KDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL25029687 0.90 NPC1 (0.40) HRH3KDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL24838147 0.87 HRH3 (0.41) HRH3KDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL25631005 0.86 KDM4E (0.52) KDM4ECYP2C9CYP2C19ALDH1A1L3MBTL1
SCHEMBL25631004 0.86 KDM4E (0.52) KDM4ECYP2C9CYP2C19ALDH1A1L3MBTL1
SCHEMBL25600556 0.83 CNR1 (0.34) HRH3KDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL25600554 0.83 CNR1 (0.34) HRH3KDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL26202563 0.81 NPC1 (0.45) KDM4ECYP2C9CYP2C19KMT2ANPC1
SCHEMBL25030889 0.79 NPC1 (0.43) KDM4ECYP2C9CYP2C19KMT2ANPC1
SCHEMBL25631007 0.79 OPRL1 (0.38) KDM4ECYP2C9CYP2C19ALDH1A1TP53

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 HRH3 3548/4885KDM4E 223/4885CYP2C9 2899/4885

“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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