SCHEMBL31290954

SCHEMBL31290954

CSc1ncc2c(C)c(Br)c(=O)n(C)c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 3/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CYP1A2 P05177 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CDK4 P11802 7/20 0.33
CCND1 P24385 7/20 0.33
CCND2 P30279 6/20 0.33
CCND3 P30281 6/20 0.33
PIM1 P11309 2/20 0.33
TTK P33981 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
KDM4E B2RXH2 2/20 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
SCHEMBL24885834 1.00 WEE1 (0.35) WEE1MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL4826130 0.79 CDK4 (0.52) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL29507845 0.79 CDK4 (0.52) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL22171265 0.77 CDK4 (0.32) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL30078181 0.77 WEE1 (0.45) WEE1MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL24885507 0.77 WEE1 (0.45) WEE1MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL22585647 0.76 CDK4 (0.39) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL31290960 0.75 WEE1 (0.34) WEE1MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL24885529 0.75 WEE1 (0.34) WEE1MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL30878929 0.75 USP19 (0.31) PIM1TTKPIM2

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-20240400577-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC 2024-12-05 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-20240400577-A1 MODULATORS OF PROTEIN KINASES MAP3K20, PRKCE, PRKCH WEE1 649/4885MEN1 3726/4885KMT2A 2661/4885

“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.