SCHEMBL23799313

SCHEMBL23799313

Cc1ccc(S(=O)(=O)n2ccc3c(Oc4ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc4F)ccnc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 1/20 0.48
PTPN1 P18031 2/20 0.41
MET P08581 2/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
BCL2 P10415 2/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
ITGA4 P13612 2/20 0.37
ITGB7 P26010 2/20 0.37
ACE P12821 1/20 0.37
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
KLK7 P49862 1/20 0.35
CTSS P25774 2/20 0.34
CTSK P43235 2/20 0.34

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
SCHEMBL23799314 1.00 MEN1 (0.48) MEN1KMT2APOLBPTPN1MET
SCHEMBL21626648 0.94 MEN1 (0.43) MEN1KMT2APOLBPTPN1MET
SCHEMBL20437163 0.91 MEN1 (0.44) MEN1KMT2APOLBPTPN1MET
SCHEMBL20437157 0.89 MEN1 (0.49) MEN1KMT2APOLBPTPN1PPARG
SCHEMBL23072680 0.88 MEN1 (0.41) MEN1KMT2APOLBMETALDH1A1
SCHEMBL20437166 0.88 MEN1 (0.41) MEN1KMT2APOLBMETALDH1A1
SCHEMBL20437153 0.88 MEN1 (0.42) MEN1KMT2APOLBPTPN1MET
SCHEMBL21593064 0.87 MET (0.40) MEN1KMT2APOLBMET
SCHEMBL23799253 0.87 MEN1 (0.41) MEN1KMT2APOLBPTPN1MET
SCHEMBL23799254 0.87 MEN1 (0.41) MEN1KMT2APOLBPTPN1MET

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-20210284639-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2021-09-16 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-20210284639-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS ROCK1, ROCK2, CIT MEN1 4507/4885KMT2A 1349/4885POLB 2768/4885

“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.