SCHEMBL25675693

SCHEMBL25675693

CN1CC2(C1)CN(c1ccc(C(C)(C)C)cc1F)C2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.34
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
ALOX5AP P20292 1/20 0.32
KDM4E B2RXH2 1/20 0.32
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
KIF11 P52732 1/20 0.31
NR1H3 Q13133 1/20 0.31
CSNK1D P48730 1/20 0.30
CSNK1G2 P78368 1/20 0.30
ALDH1A1 P00352 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
KCNH2 Q12809 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
SCHEMBL24124015 0.87 DRD2 (0.40) HSD11B1KDM4EDRD2DRD3ALDH1A1
SCHEMBL10203090 0.85 DRD2 (0.37) HSD11B1KDM4EDRD2DRD3ALDH1A1
SCHEMBL25675696 0.84 KDM4E (0.35) HSD11B1KDM4ENR1H3ALDH1A1SMN1; SMN2
SCHEMBL25675695 0.84 KIF11 (0.33) HSD11B1OPRM1OPRL1ALOX5APKIF11
SCHEMBL25675713 0.82 MAPT (0.39) HSD11B1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL10203257 0.80 ALDH1A1 (0.49) HSD11B1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL25675716 0.79 DRD2 (0.42) HSD11B1KDM4EDRD2DRD3ALDH1A1
SCHEMBL25675707 0.79 ALDH1A1 (0.42) KDM4EDRD2DRD3ALDH1A1SMN1; SMN2
SCHEMBL25675702 0.79 TSHR (0.31) KIF11
SCHEMBL25091068 0.78 ALDH1A1 (0.49) KDM4EALDH1A1TDP1

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-20230159540-A1 PYRAZOLO[3,4-d]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR (CN) 2023-05-25 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-20230159540-A1 PYRAZOLO[3,4-d]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR WEE1, WEE2, PEAK1 HSD11B1 789/4885OPRM1 4738/4885OPRL1 4580/4885

“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.