SCHEMBL6170744

SCHEMBL6170744

CCOC(=O)c1ccc(NC(C)=O)c([N+](=O)[O-])c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 1.00
ALDH1A1 P00352 5/20 0.77
POLB P06746 2/20 0.77
KDM4E B2RXH2 1/20 0.77
MAPT P10636 5/20 0.71
RAB9A P51151 2/20 0.71
PKM P14618 2/20 0.71
NPC1 O15118 1/20 0.71
CRHBP P24387 1/20 0.71
CRHR2 Q13324 1/20 0.71
LMNA P02545 3/20 0.70
PTGER4 P35408 1/20 0.67
SMN1; SMN2 Q16637 3/20 0.64
NPSR1 Q6W5P4 2/20 0.64
GALR2 O43603 1/20 0.64
MITF O75030 1/20 0.64
HSP90AA1 P07900 1/20 0.64
HPGD P15428 1/20 0.64
XBP1 P17861 1/20 0.64
CCR6 P51684 1/20 0.64

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
SCHEMBL6169182 0.90 KMT2A (0.81) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL6490589 0.87 KMT2A (0.77) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL1965205 0.86 KMT2A (0.76) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL9137225 0.86 KMT2A (0.76) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL8890463 0.86 KMT2A (0.76) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL22382354 0.85 MAPT (0.81) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL9043092 0.84 KMT2A (0.72) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL753425 0.84 KMT2A (0.72) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL4332105 0.83 KMT2A (0.71) KMT2AALDH1A1POLBKDM4EMAPT
SCHEMBL3616520 0.82 KMT2A (0.70) KMT2AALDH1A1POLBKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882718-B1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-08-31 EP disclosed
US-6869950-B1 Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-03-22 US disclosed
US-6420409-B1 GLUCOSE TOLERANCE, DIABETES,INSULIN RESISTANCE, POLYCYSTIC OVARY SYNDROME, HYPERLIPIDEMIA, ATHEROSCLEROSIS, CARDIOVASCULAR DISORDERS, HYPERGLYCEMIA, HYPERTENSION, STENOCARDIA, PULMONARY HYPERTENSION, CONGESTIVE HEART FAILURE, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
US-6352985-B1 CARDIOVASCULAR DISORDERS OR GASTROINTESTINAL DISORDERS, DIABETES (TYPE II DIABETES), DIABETIC COMPLICATIONS METHOD FOR LOWERING THE BLOOD SUGAR LEVEL OF A PATIENT, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
EP-1142880-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed
EP-1132087-A1 REMEDIES FOR POLYCYSTIC OVARY SYNDROME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-12 EP disclosed
US-6166219-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-1020452-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 EP disclosed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed