SCHEMBL24256907

SCHEMBL24256907

CCCc1[nH]c(=O)c(C#N)c2c1CCC2

nearest known ligand 0.94

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 15/20 0.94
HPGD P15428 12/20 0.94
KDM4E B2RXH2 11/20 0.94
CYP1A2 P05177 2/20 0.78
CYP2D6 P10635 1/20 0.78
CYP2C9 P11712 1/20 0.78
KMT2A Q03164 1/20 0.72
HIF1A Q16665 1/20 0.67
GAA P10253 3/20 0.49
HTT P42858 1/20 0.49
HSD11B1 P28845 3/20 0.48
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GLA P06280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL29740984 0.77 ALDH1A1 (0.70) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL9846227 0.75 ALDH1A1 (0.93) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL7271706 0.71 ALDH1A1 (1.00) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL16935293 0.71 ALDH1A1 (0.61) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL16935203 0.70 ALDH1A1 (0.96) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL16935353 0.69 ALDH1A1 (0.56) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL15923482 0.68 ALDH1A1 (0.63) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL1694783 0.68 KDM4E (0.64) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL7521074 0.68 PDE3B (0.58) ALDH1A1HPGDKDM4ECYP1A2CYP2D6
SCHEMBL16935251 0.66 ALDH1A1 (0.55) ALDH1A1HPGDKDM4ECYP1A2CYP2D6

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-20230365583-A1 FUSED TRICYCLIC PYRIMIDINE-THIENO-PYRIDINE SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 DANA-FARBER CANCER INSTITUTE, INC. 2023-11-16 US disclosed
US-20230365583-A1 FUSED TRICYCLIC PYRIMIDINE-THIENO-PYRIDINE SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 DANA-FARBER CANCER INSTITUTE, INC. 2023-11-16 US disclosed
WO-2022035806-A1 FUSED TRICYCLIC PYRIMIDINE-THIENO-PYRIDINE SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-17 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-20230365583-A1 FUSED TRICYCLIC PYRIMIDINE-THIENO-PYRIDINE SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 USP28, USP30, USP8 ALDH1A1 1934/4885HPGD 2308/4885KDM4E 1927/4885

“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.