SCHEMBL6050600

SCHEMBL6050600

Cn1cc(C(N)=O)c(=O)c2sccc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
PTK2 Q05397 1/20 0.37
PKM P14618 1/20 0.36
POLB P06746 1/20 0.36
MAP2K2 P36507 5/20 0.34
MAP2K1 Q02750 5/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK8 P45983 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
NR4A2 P43354 1/20 0.33

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
Water SCHEMBL9837052 0.98 KDM4E (0.42) KDM4EMAPTMEN1ALDH1A1KMT2A
SCHEMBL7288734 0.86 KMT2A (0.42) MAPTMEN1KMT2APOLBEGLN1
SCHEMBL20674232 0.80 BRD4 (0.45) KDM4EMAPTMEN1ALDH1A1KMT2A
SCHEMBL6050604 0.79 BAZ2B (0.47) KDM4EMAPTMEN1ALDH1A1KMT2A
SCHEMBL9836198 0.74 KDM4E (0.39) KDM4EMAPTALDH1A1MAP2K2MAP2K1
SCHEMBL1497851 0.73 CYP3A4 (0.37) MEN1ALDH1A1KMT2AMAPK1POLB
SCHEMBL1497856 0.73 LMNA (0.36) MAPTALDH1A1EGLN1
SCHEMBL9834409 0.73 KDM4E (0.41) KDM4EKMT2AMAPK1PKMMAP2K2
SCHEMBL21955856 0.71 MEN1 (0.46) MAPTMEN1ALDH1A1KMT2AMAPK1
SCHEMBL7288748 0.71 HTR3A (0.48) MEN1ALDH1A1KMT2AMAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269295-B1 THERAPEUTIC AGENTS The Boots Company PLC (GB) 1991-06-26 EP claimed
US-4877793-A CARDIOVASCULAR DISORDERS THE BOOTS COMPANY, PLC (GB) 1989-10-31 US claimed
EP-0269295-A1 Therapeutic agents The Boots Company PLC (GB) 1988-06-01 EP claimed
US-6995173-B2 Methods for the treatment of central nervous system disorders in certain patient groups R.T. ALAMO VENTURES I, LLC (US) 2006-02-07 US disclosed
US-20050009866-A1 Treatment of cardiovascular disease with quinolinone enantiomers R.T. ALAMO VENTURES I, L.L.C. (US) 2005-01-13 US disclosed
EP-1355647-A2 THE TREATMENT OF SEXUAL DYSFUNCTION AND CARDIOVASCULAR DISEASE WITH QUINOLINONE ENANTIOMERS R.T. Alamo Ventures I, LLC (US) 2003-10-29 EP disclosed
US-20030130311-A1 Methods for the treatment of central nervous system disorders in certain patient groups R.T. ALAMO VENTURES I, LLC 2003-07-10 US disclosed
US-6562838-B2 Providing subject suffering from a symptoms of cardiovascular disease and a purified enantiomer preparation of flosequinan; administering preparation to subject under conditions such that symptom is reduced R. T. ALAMO VENTURES I, L.L.C. 2003-05-13 US disclosed
US-20020147215-A1 METHODS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS IN CERTAIN PATIENT GROUPS R.T. ALAMO VENTURES I, L.L.C. 2002-10-10 US disclosed
US-20020143030-A1 TREATMENT OF GASTROPARESIS IN CERTAIN PATIENT GROUPS R.T. ALAMO VENTURES I, L.L.C, 2002-10-03 US disclosed
US-20020143031-A1 Treatment of cardiovascular disease with quinolinone enantiomers R.T. ALAMO VENTURES I, L.L.C. 2002-10-03 US disclosed
US-6458804-B1 UTILIZATION OF PHARMACEUTICAL COMPOSITIONS COMPRISING QUINOLINONES (AND DERIVATIVES THEREOF) IN PATIENTS WITH SYMPTOMS OF A CENTRAL NERVOUS SYSTEM DISORDER WHO ARE OTHERWISE FREE OF CARDIAC DISEASE AND/OR WHO HAVE NOT BEEN R.T. ALAMO VENTURESI, LLC 2002-10-01 US disclosed
US-6451813-B1 Treatment of gastroparesis in certain patient groups R. T. ALAMO VENTURES I, LLC 2002-09-17 US disclosed
WO-2002058703-A2 THE TREATMENT OF SEXUAL DYSFUNCTION AND CARDIOVASCULAR DISEASE WITH QUINOLINONE ENANTIOMERS R.T. ALAMO VENTURES I, LLC (US) 2002-08-01 WO disclosed
EP-0269295-B1 THERAPEUTIC AGENTS The Boots Company PLC (GB) 1991-06-26 EP disclosed
US-4877793-A CARDIOVASCULAR DISORDERS THE BOOTS COMPANY, PLC (GB) 1989-10-31 US disclosed
EP-0269295-A1 Therapeutic agents The Boots Company PLC (GB) 1988-06-01 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 (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-20050009866-A1 Treatment of cardiovascular disease with quinolinone enantiomers TNNT2, TNNI3, NOS3 KDM4E 871/4885MAPT 4208/4885MEN1 3691/4885
US-20030130311-A1 Methods for the treatment of central nervous system disorders in certain patient groups PMP22, NLN, SLC6A2 KDM4E 4359/4885MAPT 617/4885MEN1 2410/4885
US-20020143031-A1 Treatment of cardiovascular disease with quinolinone enantiomers TNNT2, TNNI3, NOS3 KDM4E 871/4885MAPT 4208/4885MEN1 3691/4885
US-20020147215-A1 METHODS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS IN CERTAIN PATIENT GROUPS PMP22, NLN, SLC6A2 KDM4E 4359/4885MAPT 617/4885MEN1 2410/4885
US-20020143030-A1 TREATMENT OF GASTROPARESIS IN CERTAIN PATIENT GROUPS FABP6, SLC10A2, FABP2 KDM4E 4676/4885MAPT 4569/4885MEN1 1662/4885

“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.