SCHEMBL670040

SCHEMBL670040

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)CC4)[nH]3.[Ni]

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.34
▸ STAT1 P42224 1/20 0.34

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
SCHEMBL25612 0.98 STAT3 (0.35) STAT3STAT1
SCHEMBL1684236 0.96 STAT3 (0.34) STAT3STAT1
SCHEMBL3248276 0.96 STAT3 (0.34) STAT3STAT1
SCHEMBL98554 0.96 STAT3 (0.34) STAT3STAT1
SCHEMBL6411978 0.96 STAT3 (0.37) STAT3STAT1
SCHEMBL13584886 0.94 STAT3 (0.33) STAT3STAT1
Ethylene SCHEMBL18262006 0.93 STAT3 (0.33) STAT3STAT1
Alcohol SCHEMBL10570857 0.88 STAT3 (0.31) STAT3STAT1
SCHEMBL8676983 0.88 STAT3 (0.31) STAT3STAT1
SCHEMBL29710699 0.85 STAT3 (0.41) STAT3STAT1

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-2605774-B1 MOLECULAR SWITCH UNIV KIEL CHRISTIAN ALBRECHTS (DE) 2018-11-14 — — EP disclosed
EP-2605774-A1 MOLECULAR SWITCH Christian-Albrechts-Universität zu Kiel (DE) 2013-06-26 — — EP disclosed
WO-2012022299-A1 MOLECULAR SWITCH CHRISTIAN-ALBRECHTS-UNIVERSITÄT ZU KIEL (DE) 2012-02-23 — — WO disclosed
EP-1047696-A1 SYNTHESIS OF LONG-WAVELENGTH ABSORBING PHOTOSENSITIZERS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2000-11-02 — — EP disclosed
US-6093739-A Synthesis of long wavelength absorbing photosensitizers THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2000-07-25 — — US disclosed
WO-1999026947-A1 SYNTHESIS OF LONG-WAVELENGTH ABSORBING PHOTOSENSITIZERS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 1999-06-03 — — WO disclosed
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