SCHEMBL8173271

SCHEMBL8173271

[C]1=[C]C2=Nc3ccccc3C2C=C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 0.33
NOS3 P29474 3/20 0.33
NOS2 P35228 3/20 0.33

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
SCHEMBL4938 0.73 NOS1 (0.32) NOS1NOS3NOS2
SCHEMBL2332914 0.67 NOS1 (0.33) NOS1NOS3NOS2
SCHEMBL7465174 0.62 NOS1 (0.32) NOS1NOS3NOS2
SCHEMBL1670886 0.60 NOS1 (0.33) NOS1NOS3NOS2
SCHEMBL29383163 0.60 NOS1 (0.33) NOS1NOS3NOS2
SCHEMBL4592058 0.56 NOS1 (0.36) NOS1NOS3NOS2
SCHEMBL4409993 0.55 MEN1 (0.32)
SCHEMBL28886119 0.55 NOS1 (0.42) NOS1NOS3NOS2
SCHEMBL8069320 0.53 MEN1 (0.35)
SCHEMBL30353880 0.53 MEN1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6051722-A PRECURSOR FOR POLYIMIDE COPOLYMER; USABLE IN OPTICAL LONG-DISTANCE COMMUNICATION, SIGNAL PROCESSING, PHOTOELECTRIC HYBRID CIRCUITS AND OPTICAL COMPUTERS HITACHI CHEMICAL COMPANY, LTD. (JP) 2000-04-18 US disclosed
US-5834575-A POLYIMIDE OR POLYACRYLATE WITH PENDANT GROUP CONTAINING THIOPHENE RING, BENZENE RING AND VICINAL NITRILE GROUPS, SWITCHES FOR OPTICAL SIGNALS, COMMUNICATION TECHNOLOGY HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-11-10 US disclosed