SCHEMBL8907294

SCHEMBL8907294

CC([NH])S(=O)(=O)CCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.49
POLB P06746 1/20 0.46
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
SIGMAR1 Q99720 2/20 0.41

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
SCHEMBL751883 0.78 CA2 (0.51) CA2POLBKDM4EKMT2AMEN1
SCHEMBL750645 0.78 CA2 (0.51) CA2POLBKDM4EHPGDKMT2A
SCHEMBL8906475 0.77 CA1 (0.48) CA2HPGDKMT2AMEN1ALDH1A1
SCHEMBL5700135 0.75 CA2 (0.56) CA2POLBKDM4EKMT2AMEN1
SCHEMBL12821019 0.75 POLB (0.58) CA2POLBKDM4EKMT2AMEN1
SCHEMBL777369 0.74 CA2 (0.71) CA2POLBKDM4EKMT2AMEN1
SCHEMBL12890231 0.74 KMT2A (0.50) CA2POLBHPGDKMT2AMEN1
SCHEMBL3249841 0.73 CA2 (0.48) CA2POLBKDM4EKMT2AMEN1
SCHEMBL11758463 0.73 CA2 (0.46) CA2POLBKMT2AMEN1ALDH1A1
SCHEMBL2031618 0.72 CA2 (0.58) CA2POLBKDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed
US-5587393-A ANGIOTENSIN ANTAGONIST USEFUL IN TREATING HYPERTENSION DR. KARL THOMAE GMBH (DE) 1996-12-24 US disclosed
US-5385925-A Benzimidazoles, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1995-01-31 US disclosed