SCHEMBL25966709

SCHEMBL25966709

CN1CC2(CC1=O)CN(c1cccc(Br)c1)C2

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MGLL Q99685 1/20 0.41
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.38
ALOX5 P09917 2/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA1B P35368 1/20 0.38
HSD17B10 Q99714 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD11B1 P28845 1/20 0.36

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
SCHEMBL25966710 0.78 LPL (0.36) ALDH1A1MEN1KMT2ACYP11B1CYP11B2
SCHEMBL25966704 0.74 MEN1 (0.50) ALDH1A1MEN1KMT2AMGLLGSK3A
SCHEMBL25965847 0.72 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AADAMTS5CYP11B2
SCHEMBL22914741 0.72 ENPP2 (0.40) CYP11B1CYP11B2HTR1A
SCHEMBL25967580 0.72 CYP11B1 (0.39) CYP11B1CYP11B2HTR1AADRA1B
SCHEMBL19690404 0.72 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMGLLALOX5
SCHEMBL25965845 0.72 MEN1 (0.46) ALDH1A1MEN1KMT2AMGLLALOX5
SCHEMBL19690159 0.72 MEN1 (0.47) ALDH1A1MEN1KMT2AMGLLGSK3A
SCHEMBL19464055 0.70 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AMGLLGSK3A
SCHEMBL22914738 0.70 POLB (0.50) CYP11B1CYP11B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-11-09 US disclosed
US-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-11-09 US disclosed
EP-4223754-A1 COMPOUND AS AKT KINASE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-09 EP 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-20230357242-A1 COMPOUND AS AKT KINASE INHIBITOR AKT2, MTOR, AKT1 ALDH1A1 4322/4885MEN1 1066/4885KMT2A 1901/4885

“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.