SCHEMBL25123775

SCHEMBL25123775

CCN1CCC(N2CCN(CC3CCN(C(C)C)CC3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
CHRM4 P08173 1/20 0.36
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
POLB P06746 1/20 0.35
ACHE P22303 5/20 0.34
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
OPRK1 P41145 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL24233101 0.92 POLB (0.36) KMT2APOLBACHETLR9TLR8
SCHEMBL19312863 0.89 POLB (0.36) KMT2AOPRM1OPRL1POLBACHE
SCHEMBL26143684 0.89 CHRM5 (0.38) ACHETLR9TLR8TLR7HRH3
SCHEMBL23384253 0.89 KMT2A (0.47) KMT2ACHRM4OPRM1OPRL1ACHE
SCHEMBL22828510 0.89 KMT2A (0.44) KMT2AACHETLR9TLR8TLR7
SCHEMBL24294565 0.87 ACHE (0.40) OPRM1OPRL1ACHETLR9TLR8
SCHEMBL23384251 0.87 KMT2A (0.43) KMT2ACHRM4OPRM1OPRL1ACHE
SCHEMBL25122598 0.86 CACNA2D1 (0.39) KMT2APOLBACHEHRH3KDM4E
SCHEMBL11919254 0.85 KMT2A (0.47) KMT2ACHRM4OPRM1OPRL1ACHE
SCHEMBL11919044 0.85 KMT2A (0.47) KMT2AACHEHRH3KDM4E

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-20230110180-A1 CDK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-13 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-20230110180-A1 CDK2 DEGRADERS AND USES THEREOF CDK2, CDK20, CDK1 KMT2A 290/4885CHRM4 4414/4885OPRM1 4619/4885

“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.