SCHEMBL4128614

SCHEMBL4128614

O=C(O)c1cc2ncccc2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
CSNK2A1 P68400 3/20 0.49
CSNK2A2 P19784 2/20 0.49
CSNK2B P67870 2/20 0.49
CSNK2A3 Q8NEV1 2/20 0.49
USP2 O75604 1/20 0.49
PTGS1 P23219 1/20 0.49
PIM1 P11309 5/20 0.46
PIM2 Q9P1W9 2/20 0.46
CHRNB2 P17787 1/20 0.44
CHRNA4 P43681 1/20 0.44
TDP1 Q9NUW8 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 2/20 0.42
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
NAPRT Q6XQN6 1/20 0.42

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
SCHEMBL29689092 1.00 KDM4E (0.49) KDM4ECSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL29686936 0.86 CHRNB2 (0.44) KDM4ECHRNB2CHRNA4MAPTNPC1
SCHEMBL17749939 0.84 ALDH1A1 (0.44) KDM4ECHRNB2CHRNA4L3MBTL1HSD17B10
SCHEMBL6281582 0.80 HTT (0.50) KDM4ECHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL11248491 0.78 GPR35 (0.57) KDM4ECHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL24776512 0.78 MEN1 (0.40) USP2CHRNB2CHRNA4HSD17B10MAPT
SCHEMBL24620866 0.77 F7 (0.46) KDM4EUSP2PIM1PIM2L3MBTL1
SCHEMBL30973431 0.75 PIM1 (0.42) KDM4ECSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL31429009 0.75 RAB9A (0.52) KDM4EL3MBTL1HSD17B10MAPTHPGD
SCHEMBL10513311 0.74 CA2 (0.54) CHRNB2CHRNA4HPGDHTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060194787-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2006-08-31 US claimed
US-20050256104-A1 substituted 1,1,4-1l6-trioxo[1,2]thiazepan-4-ylamide-derived protease inhibitors which inhibit the likes of cathepsin K; treating osteoporosis, osteo- and rheumatoid arthritis and periodontal disease; inhibiting excessive cartilage or matrix degradation SMITHKLINE BEECHAM CORPORATION 2005-11-17 US claimed
EP-1307203-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2005-08-17 EP claimed
US-20040044201-A1 Protease inhibitors GLAXOSMITHKLINE LLC 2004-03-04 US claimed
US-20040002487-A1 Protease inhibitors MARQUIS ROBERT WELLS (US) 2004-01-01 US claimed
US-20030225061-A1 Protease inhibitors MARQUIS ROBERT WELLS (US) 2003-12-04 US claimed
CN-1444481-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2003-09-24 CN claimed
US-20030144175-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2003-07-31 US claimed
EP-1307203-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-05-07 EP claimed
US-20020147188-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-10-10 US claimed
WO-2001070232-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-27 WO claimed
EP-4007758-B1 BIS-[N-((5-CARBAMOYL)-1H-BENZO[D]IMIDAZOL-2-YL)-PYRAZOL-5-CARBOXAMIDE] DERIVATIVES AND RELATED COMPOUNDS AS STING (STIMULATOR OF INTERFERON GENES) AGONISTS FOR THE TREATMENT OF CANCER MERSANA THERAPEUTICS INC (US) 2026-05-13 EP disclosed
EP-3856179-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-05-13 EP disclosed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
EP-3856178-B1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2026-03-11 EP disclosed
WO-2001095911-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-12-20 WO disclosed
US-20010044538-A1 p38 MAP kinase inhibitors CHENG SOAN (US) 2001-11-22 US disclosed
US-6316464-B1 P38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC 2001-11-13 US disclosed
WO-2001070232-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-27 WO disclosed
EP-0277661-A1 Imidazopyrrolopyridines and condensed derivatives thereof useful in the preparation of herbicidal compounds AMERICAN CYANAMID COMPANY (US) 1988-08-10 EP 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 (9 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-20030225061-A1 Protease inhibitors CTSK, MMP13, CTSZ KDM4E 917/4885CSNK2A1 607/4885CSNK2A2 711/4885
US-20060194787-A1 Protease inhibitors CTSK, CTSL, CTSZ KDM4E 1163/4885CSNK2A1 1469/4885CSNK2A2 1840/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH KDM4E 3565/4885CSNK2A1 1260/4885CSNK2A2 1289/4885
US-20040044201-A1 Protease inhibitors CTSK, CTSE, CTSZ KDM4E 763/4885CSNK2A1 1829/4885CSNK2A2 2185/4885
US-20050256104-A1 substituted 1,1,4-1l6-trioxo[1,2]thiazepan-4-ylamide-derived protease inhibitors which inhibit the likes of cathepsin K; treating osteoporosis, osteo- and rheumatoid arthritis and periodontal disease; inhibiting excessive cartilage or matrix degradation CTSK, CTSZ, CTSE KDM4E 875/4885CSNK2A1 276/4885CSNK2A2 386/4885
US-20020147188-A1 Protease inhibitors CTSK, MMP13, CTSZ KDM4E 917/4885CSNK2A1 607/4885CSNK2A2 711/4885
US-20010044538-A1 p38 MAP kinase inhibitors MAPK1, MAPK8, MAP3K1 KDM4E 4225/4885CSNK2A1 104/4885CSNK2A2 148/4885
US-20040002487-A1 Protease inhibitors CTSK, MMP13, CTSZ KDM4E 917/4885CSNK2A1 607/4885CSNK2A2 711/4885
US-20030144175-A1 Protease inhibitors CTSK, MMP13, CTSZ KDM4E 917/4885CSNK2A1 607/4885CSNK2A2 711/4885

“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.