SCHEMBL22565085

SCHEMBL22565085

CN1CCC2(CC1)CN(C1CCN(C)C1)C2

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.35
NCF1 P14598 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL22565061 0.90 ALDH1A1 (0.41) ALDH1A1KMT2ANCF1L3MBTL3L3MBTL1
SCHEMBL22565986 0.89 CYP3A4 (0.33) ALDH1A1KMT2A
SCHEMBL24697464 0.87 ALDH1A1 (0.35) ALDH1A1
SCHEMBL24697413 0.87 ALDH1A1 (0.35) ALDH1A1
SCHEMBL22565072 0.86 CYP3A4 (0.31) ALDH1A1KMT2A
SCHEMBL24480849 0.85 ALDH1A1 (0.36) ALDH1A1KMT2AL3MBTL3L3MBTL1
SCHEMBL24697412 0.85 ALDH1A1 (0.33) ALDH1A1KMT2A
SCHEMBL22565062 0.85 HRH3 (0.32) ALDH1A1
SCHEMBL26743381 0.84 ALDH1A1 (0.36) ALDH1A1KMT2ANCF1
SCHEMBL24996228 0.84 ALDH1A1 (0.42) ALDH1A1NCF1L3MBTL3L3MBTL1

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-20230357193-A1 COMPOUND CAPABLE OF INHIBITING AND DEGRADING ANDROGEN RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICAL USES THEREOF XIZANG HAISCO PHARMACEUTICALS CO., LTD. (CN) 2023-11-09 US disclosed
WO-2020211822-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF 成都海创药业有限公司 2020-10-22 WO 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-20230357193-A1 COMPOUND CAPABLE OF INHIBITING AND DEGRADING ANDROGEN RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICAL USES THEREOF AR, CYP17A1, KLK3 ALDH1A1 861/4885KMT2A 2950/4885NCF1 4215/4885

“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.