SCHEMBL25786362

SCHEMBL25786362

CC(C)C[C@@H]1CCCN(CCO)C1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CCR5 P51681 1/20 0.34
CYP2D6 P10635 2/20 0.33
HRH1 P35367 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL23178869 0.89 SLC18A3 (0.35) ALDH1A1CARM1PRMT6KDM4EKMT2A
SCHEMBL24701555 0.87 ALDH1A1 (0.36) ALDH1A1CARM1PRMT6KDM4ECCR5
SCHEMBL10052290 0.86 CARM1 (0.37) CARM1PRMT6KDM4ECCR5
SCHEMBL20233050 0.80 BCHE (0.43) ALDH1A1CARM1PRMT6
SCHEMBL22020562 0.80 CYP3A4 (0.35) KDM4ECYP2D6
SCHEMBL12713 0.80 BCHE (0.43) ALDH1A1CARM1PRMT6
SCHEMBL9925435 0.80 CYP3A4 (0.35) KDM4ECYP2D6
SCHEMBL13036991 0.80 BCHE (0.43) ALDH1A1CARM1PRMT6
SCHEMBL26345081 0.80 PIK3CD (0.41) ALDH1A1CARM1PRMT6KDM4EMEN1
SCHEMBL3431959 0.80 CYP2D6 (0.47) ALDH1A1CARM1PRMT6CYP2D6KMT2A

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-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 US disclosed
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 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-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors MCL1, BCL2A1, BCL2L1 ALDH1A1 370/4885CARM1 481/4885PRMT6 309/4885

“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.