SCHEMBL5964524

SCHEMBL5964524

CC(=O)N1CCC(Br)C1=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
ROCK2 O75116 1/20 0.31
CASP6 P55212 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL17977068 0.81 ACE (0.31)
SCHEMBL8779711 0.79 CYP3A4 (0.33)
SCHEMBL21946000 0.77 NOTUM (0.33) NOTUMCASP6MAPK1
SCHEMBL8379231 0.77 PIK3CD (0.41) NOTUMMAPK1
SCHEMBL10371339 0.72 ROCK2 (0.32) CHRNB2CHRNA4ROCK2
SCHEMBL20931143 0.69
SCHEMBL5638082 0.67 CYP3A4 (0.42) NOTUM
SCHEMBL13751309 0.65 USP2 (0.36) NOTUM
SCHEMBL4335919 0.64 NOTUM (0.39) NOTUMMAPK1
SCHEMBL3123660 0.64 NOTUM (0.39) NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116921-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN INC. 2024-04-11 US disclosed
EP-4267137-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 Enliven Inc. (US) 2023-11-01 EP disclosed
WO-2022140769-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
WO-2022140769-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
CN-1821226-A Antipicornaviral compounds, their preparation and use AGOURON PHARMA (US) 2006-08-23 CN disclosed
US-20060046966-A1 Antipicornaviral compounds and compositions, their pharmaceutical uses, and materials for their synthesis AGOURON PHARMACEUTICALS, INC. 2006-03-02 US disclosed
US-6995142-B2 Antipicornaviral compounds and compositions, their pharmaceutical uses, and materials for their synthesis AGOURON PHARMACEUTICALS, INC. (US) 2006-02-07 US disclosed
US-6906198-B1 Antipicornaviral compounds, their preparation and use AGOURON PHARMACEUTICALS, INC. (US) 2005-06-14 US disclosed
CN-1198838-C Anti-small RNA virus compound and preparation method and application thereof AGOURON PHARMA (US) 2005-04-27 CN disclosed
US-20040072907-A1 Antipicornaviral compounds, compositions containing them, and methods for their use PETER DRAGOVICH S (US) 2004-04-15 US disclosed
EP-1073672-B1 ANTIPICORNAVIRAL COMPOUNDS, THEIR PREPARATION AND USE AGOURON PHARMA (US) 2003-08-27 EP disclosed
EP-1329457-A2 Antipicornaviral compounds, their preparation and use AGOURON PHARMACEUTICALS, INC. (US) 2003-07-23 EP disclosed
US-20030130204-A1 Antipicornaviral compounds and compositons, their pharmaceutical uses, and materials for their synthesis DRAGOVICH PETER SCOTT (US) 2003-07-10 US disclosed
US-6531452-B1 Peptide-like and peptidomimetic compounds that inhibit enzymatic activity of picornaviral 3C proteases and inhibit picornavirus replication AGOURON PHARMACEUTICALS, INC. 2003-03-11 US disclosed
US-20020032237-A1 Antipicornaviral compounds, compositions containing them, and methods for their use DRAGOVICH PETER S (US) 2002-03-14 US disclosed
US-6331554-B1 PICORNAVIRUS PROTEASE INHIBITORS AGOURON PHARMACEUTICALS, INC. 2001-12-18 US disclosed
CN-1311793-A Anti-small RNA virus compound and preparation method and application thereof AGOURON PHARMA (US) 2001-09-05 CN disclosed
EP-1073672-A1 ANTIPICORNAVIRAL COMPOUNDS, THEIR PREPARATION AND USE AGOURON PHARMACEUTICALS, INC. (US) 2001-02-07 EP disclosed
US-6020371-A VIRICIDES; PROTEASE INHIBITORS AGOURON PHARMACEUTICALS, INC. (US) 2000-02-01 US disclosed
WO-1999057135-A1 ANTIPICORNAVIRAL COMPOUNDS, THEIR PREPARATION AND USE AGOURON PHARMACEUTICALS, INC. (US) 1999-11-11 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 (5 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-20240116921-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ERBB2, FGFR2, ERBB3 NOTUM 1486/4885CHRNB2 4062/4885CHRNA4 4669/4885
US-20020032237-A1 Antipicornaviral compounds, compositions containing them, and methods for their use RNASEL, RNASE1, GTF3C3 NOTUM 1338/4885CHRNB2 4871/4885CHRNA4 4878/4885
US-20040072907-A1 Antipicornaviral compounds, compositions containing them, and methods for their use PCNA, ZC3HAV1, POLR1C NOTUM 3599/4885CHRNB2 4694/4885CHRNA4 4444/4885
US-20060046966-A1 Antipicornaviral compounds and compositions, their pharmaceutical uses, and materials for their synthesis PRCP, RNPEP, SARNP NOTUM 2316/4885CHRNB2 4871/4885CHRNA4 4884/4885
US-20030130204-A1 Antipicornaviral compounds and compositons, their pharmaceutical uses, and materials for their synthesis SARNP, RNASE1, SERPINA3 NOTUM 2062/4885CHRNB2 4853/4885CHRNA4 4877/4885

“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.