SCHEMBL9209136

SCHEMBL9209136

Cc1cc([NH])c(I)c(C)n1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.32
NOS2 P35228 2/20 0.32
POLB P06746 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
NOS1 P29475 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
SCHEMBL26841823 0.75 KDM4E (0.37) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL26709437 0.71 LMNA (0.39) POLBAPOBEC3G
SCHEMBL9209139 0.71 NCF1 (0.41) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL10200506 0.71 JAK3 (0.35) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL9215459 0.71 LMNA (0.35) NOS3NOS2POLBAPOBEC3G
SCHEMBL12503229 0.68 NOS3 (0.41) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL10200515 0.67 TTR (0.46) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL7942579 0.66 PSMB5 (0.36)
SCHEMBL11985899 0.65 POLB (0.35) NOS3NOS2POLBAPOBEC3GNOS1
SCHEMBL1427726 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520724-B1 Angiotensin II antagonists ZENECA LTD (GB) 1995-09-20 EP disclosed
US-5387592-A Angiotensin converting enzyme inhibitors, calcium channel blockers, diuretics and adrenergic blocking agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-02-07 US disclosed
EP-0520723-B1 Angiotensin II antagonists ICI PLC (GB) 1994-06-01 EP disclosed
US-5281613-A Heterocyclic ring substituted benzofuran, benzothiofuran, or indole derivative IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-25 US disclosed
EP-0520723-A1 Angiotensin II antagonists IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-30 EP disclosed
EP-0520724-A1 Angiotensin II antagonists ZENECA LIMITED (GB) 1992-12-30 EP disclosed