SCHEMBL7056937

SCHEMBL7056937

CCCSc1ncc(C[C@H](NC(=O)CCC)C(=O)OCC)n1Cc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.46
ALDH1A1 P00352 5/20 0.40
HSD17B10 Q99714 2/20 0.40
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MAPT P10636 6/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL8957161 0.92 TP53 (0.40) TP53ALDH1A1HSD17B10ADORA3ADORA2A
SCHEMBL7056869 0.91 TP53 (0.45) TP53ALDH1A1MAPTRXFP1
SCHEMBL7056939 0.86 PTGES (0.41)
SCHEMBL8971301 0.85 TP53 (0.44) TP53ALDH1A1HTT
SCHEMBL8971303 0.85 TP53 (0.44) TP53ALDH1A1HTT
SCHEMBL8954186 0.84 TP53 (0.46) TP53ALDH1A1HSD17B10ADORA3ADORA2A
SCHEMBL7056477 0.84 TP53 (0.46) TP53ALDH1A1HSD17B10ADORA3ADORA2A
SCHEMBL7056482 0.84 TP53 (0.46) TP53ALDH1A1HSD17B10ADORA3ADORA2A
SCHEMBL9507591 0.83 FNTA (0.39) TP53ADORA3ADORA2AADORA1MAPT
SCHEMBL8957111 0.83 TP53 (0.44) TP53ADORA3ADORA2AADORA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030187044-A1 Medicament SMITHKLINE BEECHAM P.L.C. 2003-10-02 US disclosed
US-20030166700-A1 Administering a substituted imidazoles to a mammal for the treatment of athroma progression and regression SMITHKLINE BEECHAM P.L.C. 2003-09-04 US disclosed
US-20030096851-A1 Medicament SMITHKLINE BEECHAM P.L.C. 2003-05-22 US disclosed
US-20030069293-A1 Medicament SMITHKLINE BEECHAM PLC 2003-04-10 US disclosed
US-20030050285-A1 Substituted imidazoles; angiotensin II receptor antagonist for the treatment of hemorrhagic stroke SMITHKLINE BEECHAM P.L.C. 2003-03-13 US disclosed
US-20030004201-A1 Medicament SMITHKLINE BEECHAM P.L.C. 2003-01-02 US disclosed
US-20020160985-A1 Medicament SMITHKLINE BEECHAM PLC 2002-10-31 US disclosed
US-20020132840-A1 Treating angina in a mammal by administering an angiotensin II receptor antagonist. SMITHKLINE BEECHAM P.1.C. 2002-09-19 US disclosed
US-20020086893-A1 Imidazole based angiotensin II receptor antagonist for treating haemorrhagic stroke SMITHKLINE BEECHAM P.L.C. 2002-07-04 US disclosed
US-20020068759-A1 Medicament SMITHKLINE BEECHAM PLC 2002-06-06 US disclosed
WO-1992010183-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF DIABETIC RETINOPATHY SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010185-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE PREVENTION OF RESTINOSIS SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010184-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF ATHEROMA SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010186-A1 USE OF ANGIOTENSN II RECEPTOR ANTAGONISTS FOR THE PREPARATION OF A MEDICAMENT FOR IMPROVING COGNITIVE FUNCTION SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010097-A1 ANGIOTENSIN II RECEPTOR BLOCKING COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 1992-06-25 WO disclosed
WO-1992010182-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF DIABETIC NEPHROPATHY SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010188-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF HEMORRAGIC STROKE SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010179-A1 USE OF ANGIOTENSIN II RECEPTOR ANTAGONISTS IN THE TREATMENT OF MACULAR DEGENERATION SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992010180-A1 USE OF ANGIOTENSIN II ANTAGONIST IN THE TREATMENT OF INFARCTION SMITHKLINE BEECHAM PLC (GB) 1992-06-25 WO disclosed
WO-1992000068-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-09 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-20020160985-A1 Medicament AGTR2, AGTR1, ACE TP53 3913/4885ALDH1A1 932/4885HSD17B10 2804/4885
US-20020132840-A1 Treating angina in a mammal by administering an angiotensin II receptor antagonist. AGTR2, AGTR1, AGT TP53 4866/4885ALDH1A1 1058/4885HSD17B10 2415/4885
US-20030187044-A1 Medicament AGTR2, AGTR1, ACE TP53 3163/4885ALDH1A1 2570/4885HSD17B10 2633/4885
US-20020086893-A1 Imidazole based angiotensin II receptor antagonist for treating haemorrhagic stroke AGTR2, AGTR1, VIPR2 TP53 4583/4885ALDH1A1 1027/4885HSD17B10 3019/4885
US-20030004201-A1 Medicament AGTR2, AGTR1, ACE TP53 3514/4885ALDH1A1 1824/4885HSD17B10 2181/4885
US-20030166700-A1 Administering a substituted imidazoles to a mammal for the treatment of athroma progression and regression AGTR1, AGTR2, AGT TP53 3432/4885ALDH1A1 650/4885HSD17B10 2665/4885
US-20020068759-A1 Medicament AGTR2, AGTR1, ACE TP53 3913/4885ALDH1A1 932/4885HSD17B10 2804/4885
US-20030096851-A1 Medicament AGTR2, AGTR1, ACE TP53 3163/4885ALDH1A1 2570/4885HSD17B10 2633/4885
US-20030050285-A1 Substituted imidazoles; angiotensin II receptor antagonist for the treatment of hemorrhagic stroke AGTR2, AGTR1, ACE TP53 3465/4885ALDH1A1 782/4885HSD17B10 3111/4885
US-20030069293-A1 Medicament AGTR2, AGTR1, ACE TP53 3913/4885ALDH1A1 932/4885HSD17B10 2804/4885

“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.