SCHEMBL7660263

SCHEMBL7660263

CCC(O)CCS(N)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.33
CA1 P00915 2/20 0.33
CA7 P43166 2/20 0.33
CA4 P22748 1/20 0.33
CA9 Q16790 1/20 0.33
GCLC P48506 1/20 0.32
ENPEP Q07075 1/20 0.31
TP53 P04637 1/20 0.30
CA12 O43570 1/20 0.30
CA14 Q9ULX7 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
SCHEMBL12186661 0.81 CA1 (0.30) CA2CA1CA7ENPEPCA14
SCHEMBL28028704 0.79 FFAR4 (0.48) CA2CA1CA7CA4CA9
SCHEMBL12164299 0.78 PTGS1 (0.36) ENPEPTP53
SCHEMBL29260434 0.78 PLA2G2C (0.33)
SCHEMBL15754446 0.76 PTGS1 (0.35) ENPEPTP53
SCHEMBL10823196 0.75
SCHEMBL15754444 0.74 ENPEP (0.42) ENPEPTP53
Sulfuric Acid SCHEMBL4807136 0.74 TP53 (0.39) TP53
SCHEMBL20599567 0.74
Sulfuric Acid SCHEMBL4808298 0.74 TP53 (0.39) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1135224-C Benzimidazole derivatives ����ҩƷ��ҵ��ʽ���� 2004-01-21 CN 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
CN-1268123-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-09-27 CN disclosed
EP-1020452-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 EP disclosed