SCHEMBL25600554

SCHEMBL25600554

CC(C)CCC(=O)N1CCN(C2CC3(CC(C(=O)C(C)C)C3)C2)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ HRH3 Q9Y5N1 9/20 0.33
▸ NAMPT P43490 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL25600556 1.00 CNR1 (0.34) CNR1CNR2HRH3NAMPTKDM4E
SCHEMBL25605839 0.88 EPHX1 (0.35) HRH3NPC1ALDH1A1L3MBTL1TSHR
SCHEMBL25600551 0.87 KDM4E (0.43) KDM4ECYP2C9CYP2C19NPC1ALDH1A1
SCHEMBL25600549 0.87 KDM4E (0.43) KDM4ECYP2C9CYP2C19NPC1ALDH1A1
SCHEMBL25631008 0.83 HRH3 (0.40) CNR1CNR2HRH3KDM4ECYP2C9
SCHEMBL25605834 0.83 HRH3 (0.40) CNR1CNR2HRH3KDM4ECYP2C9
SCHEMBL25029687 0.73 NPC1 (0.40) HRH3KDM4ECYP2C9CYP2C19NPC1
SCHEMBL24838147 0.73 HRH3 (0.41) CNR1CNR2HRH3KDM4ECYP2C9
SCHEMBL25605805 0.73 EPHX1 (0.37) HRH3ALDH1A1L3MBTL1TSHRKMT2A
SCHEMBL25604717 0.72 KDM4E (0.42) HRH3KDM4ECYP2C19ALDH1A1KMT2A

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 2 patents. 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
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 CNR1 4065/4885CNR2 4507/4885HRH3 3548/4885

“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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