SCHEMBL25966765

SCHEMBL25966765

O=C1N(C2CCNCC2)CCC1(F)F

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
HTR2C P28335 8/20 0.33
HTR2B P41595 7/20 0.33
HSD11B1 P28845 4/20 0.33
HTR2A P28223 4/20 0.33
FPR2 P25090 1/20 0.32
PARP1 P09874 2/20 0.32
PARP2 Q9UGN5 3/20 0.31
PARP3 Q9Y6F1 2/20 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
SCHEMBL25963066 0.78 CHRM2 (0.41) HSD11B1PARP2
SCHEMBL31266652 0.78 MAPK1 (0.38) HSD11B1
SCHEMBL26884894 0.74 PARP1 (0.38) HSD11B1PARP1PARP2
SCHEMBL26881042 0.74 GRIN2D (0.31) HSD11B1
SCHEMBL20952557 0.72 HRH3 (0.41) TP53HTR2CHTR2BHSD11B1HTR2A
Hydrochloric Acid SCHEMBL20475439 0.70 HRH3 (0.41) TP53HSD11B1
SCHEMBL25966764 0.70 CTSD (0.48) TP53FPR2
SCHEMBL30948807 0.69 HTR2C (0.38) HTR2CHTR2BHTR2APARP1
SCHEMBL726957 0.68 HTR2C (0.40) TP53HTR2CHTR2BHSD11B1HTR2A
SCHEMBL994623 0.68 HTR2C (0.40) TP53HTR2CHTR2BHTR2AFPR2

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-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 TP53 1795/4885HTR2C 3480/4885HTR2B 3266/4885

“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.