SCHEMBL718210

SCHEMBL718210

Cc1nc(N)[nH]c(=O)c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.52
XDH P47989 1/20 0.52
CYP1A2 P05177 1/20 0.47
PNP P00491 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TYMP P19971 1/20 0.43
MAPT P10636 1/20 0.42
CDK1 P06493 1/20 0.42
CDK4 P11802 1/20 0.42
CDK2 P24941 1/20 0.42
MITF O75030 1/20 0.41
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.41
ALOX15 P16050 1/20 0.41
HBB P68871 1/20 0.41
HIF1A Q16665 1/20 0.41
QTRT1 Q9BXR0 1/20 0.39

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
SCHEMBL12956972 0.81 CDK1 (0.52) NPSR1XDHCYP1A2PNPALDH1A1
SCHEMBL12284639 0.81 ALDH1A1 (0.65) NPSR1XDHCYP1A2PNPMAPK1
SCHEMBL1687020 0.77 XDH (0.49) NPSR1XDHCYP1A2PNPMAPK1
SCHEMBL9653630 0.77 NPSR1 (0.49) NPSR1XDHCYP1A2PNPMAPK1
SCHEMBL18092890 0.77 NPSR1 (0.49) NPSR1XDHCYP1A2PNPMAPK1
SCHEMBL172127 0.75 ALDH1A1 (0.58) MAPK1KMT2AALDH1A1L3MBTL1MAPT
SCHEMBL19506131 0.74 XDH (0.46) NPSR1XDHCYP1A2PNPKMT2A
SCHEMBL12652113 0.74 CDK1 (0.66) NPSR1CYP1A2PNPMAPK1KMT2A
SCHEMBL8201950 0.74 XDH (0.46) NPSR1XDHCYP1A2PNPKMT2A
SCHEMBL27053802 0.71 NPSR1 (0.35) NPSR1XDHCYP1A2MAPK1ALDH1A1

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-27 US disclosed
WO-2024119117-A1 MODIFIED 5' CAP FOR MRNA AND METHODS OF USE THEREOF PRIME MEDICINE, INC. (US) 2024-06-06 WO disclosed
US-20230381177-A1 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE TES PHARMA S.R.L. (IT) 2023-11-30 US disclosed
US-20230340009-A1 COMPOUNDS FOR RNA CAPPING AND USES THEREOF GUANGZHOU HENOVCOM BIOSCIENCE CO., LTD. (CN) 2023-10-26 US disclosed
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 US disclosed
WO-2023147092-A9 CORONAVIRUS VACCINE BioNTech SE (DE) 2023-09-28 WO disclosed
WO-2023147092-A2 CORONAVIRUS VACCINE BioNTech SE (DE) 2023-08-03 WO disclosed
WO-2023147091-A1 CORONAVIRUS VACCINE BioNTech SE (DE) 2023-08-03 WO disclosed
US-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2023-05-11 US disclosed
US-20230010731-A1 DNA SEQUENCING BY SYNTHESIS USING MODIFIED NUCLEOTIDES AND NANOPORE DETECTION THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-01-12 US disclosed
US-20050209261-A1 Rho-kinase inhibitors BAYER HEALTHCARE LLC 2005-09-22 US disclosed
US-6943172-B2 Rho-kinase inhibitors BAYER PHARMACEUTICALS CORPORATION (US) 2005-09-13 US disclosed
US-20050192304-A1 Rho-kinase inhibitors BAYER HEALTHCARE LLC 2005-09-01 US disclosed
US-6924290-B2 Rho-kinase inhibitors BAYER PHARMACEUTICALS CORPORATION (US) 2005-08-02 US disclosed
EP-1470122-A1 RHO-KINASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-10-27 EP disclosed
EP-1470121-A1 PYRIMIDINE DERIVATIVES AS RHO-KINASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-10-27 EP disclosed
US-20040002507-A1 Rho-kinase inhibitors BAYER CORPORATION (US) 2004-01-01 US disclosed
US-20040002508-A1 Antitumor agents; anticancer agents; sexual disorders; cardiovascular disorders BAYER CORPORATION 2004-01-01 US disclosed
WO-2003062227-A1 RHO-KINASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-07-31 WO disclosed
WO-2003062225-A1 PYRIMIDINE DERIVATIVES AS RHO-KINASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-07-31 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 (10 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-20040002507-A1 Rho-kinase inhibitors CIT, ROCK1, ROCK2 NPSR1 2679/4885XDH 598/4885CYP1A2 1810/4885
US-20230010731-A1 DNA SEQUENCING BY SYNTHESIS USING MODIFIED NUCLEOTIDES AND NANOPORE DETECTION POLN, DNTT, NT5C3B NPSR1 777/4885XDH 4827/4885CYP1A2 3882/4885
US-20230340009-A1 COMPOUNDS FOR RNA CAPPING AND USES THEREOF RNGTT, RNMT, NSUN2 NPSR1 3715/4885XDH 2161/4885CYP1A2 4334/4885
US-20240209017-A1 STING MODULATOR COMPOUNDS, AND METHODS OF MAKING AND USING STING1, CGAS, MAVS NPSR1 1625/4885XDH 1208/4885CYP1A2 4580/4885
US-20050209261-A1 Rho-kinase inhibitors CIT, ROCK1, ROCK2 NPSR1 2679/4885XDH 598/4885CYP1A2 1810/4885
US-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, MAVS NPSR1 1687/4885XDH 424/4885CYP1A2 4107/4885
US-20040002508-A1 Antitumor agents; anticancer agents; sexual disorders; cardiovascular disorders CIT, ROCK1, RHOT2 NPSR1 2019/4885XDH 564/4885CYP1A2 1660/4885
US-20230381177-A1 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE ACMSD, GLS, ALDH7A1 NPSR1 2669/4885XDH 119/4885CYP1A2 1119/4885
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators STING1, CGAS, IRF3 NPSR1 2401/4885XDH 1579/4885CYP1A2 4751/4885
US-20050192304-A1 Rho-kinase inhibitors CIT, ROCK1, ROCK2 NPSR1 2679/4885XDH 598/4885CYP1A2 1810/4885

“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.