SCHEMBL4202258

SCHEMBL4202258

c1cc[n+](-c2cccc[n+]2-c2ncccn2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS3 P29474 1/20 0.32
▸ NOS1 P29475 1/20 0.32
▸ NOS2 P35228 1/20 0.32
▸ PI4KA P42356 1/20 0.32
▸ PI4K2B Q8TCG2 1/20 0.32
▸ PI4K2A Q9BTU6 1/20 0.32
▸ PI4KB Q9UBF8 1/20 0.32
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ CCR1 P32246 1/20 0.30
▸ CCR5 P51681 1/20 0.30
▸ CCR8 P51685 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
SCHEMBL4198862 0.81 NOS3 (0.34) NOS3NOS1NOS2PI4KAPI4K2B
SCHEMBL1532287 0.81 NOS3 (0.34) NOS3NOS1NOS2PI4KAPI4K2B
SCHEMBL7961756 0.78 NOS3 (0.32) NOS3NOS1NOS2PI4KAPI4K2B
SCHEMBL4199511 0.73 HDAC8 (0.33) NOS3NOS1NOS2PI4KAPI4K2B
SCHEMBL7961763 0.68 — —
SCHEMBL29391746 0.67 — —
SCHEMBL40911 0.66 HDAC8 (0.42) NOS3NOS1NOS2PI4KAPI4K2B
SCHEMBL1551556 0.66 HDAC8 (0.42) NOS3NOS1NOS2PI4KAPI4K2B
Hydrochloric Acid SCHEMBL1882279 0.66 HDAC8 (0.42) NOS3NOS1NOS2PI4KAPI4K2B
Hydrochloric Acid SCHEMBL2635755 0.64 HDAC8 (0.41) NOS3NOS1NOS2PI4KAPI4K2B

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-1154311-A9 ELECTROCHROMIC ELEMENT Nippon Mitsubishi Oil Corporation (JP) 2009-03-11 — — EP disclosed
US-6816298-B2 CAN BE PRODUCED WITH INEXPENSIVE CHROMOGENIC MATERIALS; DISPLAY DEVICES, SMART WINDOWS, ANTIGLARE MIRRORS FOR AUTOMOBILES, ELECTROCHROMIC MIRRORS; A BIPYRIDINIUM METALLOCENE COMPOUND IN THE ION CONDUCTIVE LAYER NIPPON MITSUBISHI OIL CORPORATION (JP) 2004-11-09 — — US disclosed
US-20030184839-A1 Electrochromic device NIPPON MITSUBISHI OIL CORPORATION 2003-10-02 — — US disclosed
US-6519072-B2 Electrochromic device NIPPON MITSUBISHI OIL CORPORATION (JP) 2003-02-11 — — US disclosed
US-20020015214-A1 Electrochromic Device NIPPON MITSUBISHI OIL CORPORATION 2002-02-07 — — US disclosed
EP-1154311-A1 ELECTROCHROMIC ELEMENT Nippon Mitsubishi Oil Corporation (JP) 2001-11-14 — — EP disclosed
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