SCHEMBL20437150

SCHEMBL20437150

COC(=O)[C@H](Cc1ccc(Oc2ccnc3c2c(C)cn3S(=O)(=O)c2ccc(C)cc2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 4/20 0.40
P2RX7 Q99572 2/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
KLK7 P49862 1/20 0.38
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
ABCB1 P08183 1/20 0.36
MMP13 P45452 1/20 0.36
KLK5 Q9Y337 1/20 0.36
ALOX5 P09917 2/20 0.36
YAP1 P46937 1/20 0.35
ITGA4 P13612 1/20 0.35
ITGB7 P26010 1/20 0.35
HDAC8 Q9BY41 1/20 0.34
PTPN1 P18031 1/20 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
SCHEMBL20437152 1.00 BCL2 (0.40) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20437155 0.93 ITGB3 (0.44) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL23072642 0.93 ITGB3 (0.44) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20437156 0.93 ITGB3 (0.44) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20437151 0.89 MEN1 (0.37) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20806018 0.88 P2RX7 (0.33) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20422562 0.87 MEN1 (0.44) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20437154 0.87 MEN1 (0.44) BCL2P2RX7MEN1POLBKMT2A
SCHEMBL20437176 0.84 PTGS2 (0.39) ITGB3ALOX5
SCHEMBL20437178 0.83 PKM (0.34) P2RX7MEN1KMT2AITGB3ALOX5

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954236-B2 Tyrosine amide derivatives as Rho-Kinase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2021-03-23 US disclosed
EP-3573987-B1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARM SPA (IT) 2021-03-10 EP disclosed
US-20180215758-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2018-08-02 US disclosed
US-20180215758-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2018-08-02 US disclosed
WO-2018138293-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2018-08-02 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 (2 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-10954236-B2 Tyrosine amide derivatives as Rho-Kinase inhibitors ROCK1, ROCK2, CIT BCL2 4112/4885P2RX7 3476/4885MEN1 4596/4885
US-20180215758-A1 TYROSINE AMIDE DERIVATIVES AS RHO- KINASE INHIBITORS ROCK1, ROCK2, CIT BCL2 4112/4885P2RX7 3476/4885MEN1 4596/4885

“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.