SCHEMBL16868829

SCHEMBL16868829

CCCCCCc1cc(CCCCCC)cc(-c2c3nc(cc4ccc([nH]4)c(-c4cc(CCCCCC)cc(CCCCCC)c4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.52
▸ STAT1 P42224 1/20 0.52
▸ TERT O14746 2/20 0.36
▸ S1PR4 O95977 1/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ S1PR5 Q9H228 1/20 0.35
▸ PTGS2 P35354 2/20 0.33
▸ CTSV O60911 1/20 0.32
▸ CTSL P07711 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ HTR1D P28221 1/20 0.32
▸ HTR1B P28222 1/20 0.32
▸ SPHK2 Q9NRA0 1/20 0.31
▸ TOP1 P11387 2/20 0.31

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
SCHEMBL16882035 0.95 STAT3 (0.47) STAT3STAT1TERTS1PR4S1PR1
SCHEMBL16882034 0.93 STAT3 (0.48) STAT3STAT1TERTS1PR4S1PR1
SCHEMBL16868831 0.92 STAT3 (0.45) STAT3STAT1TERTS1PR4S1PR1
SCHEMBL585685 0.83 STAT3 (0.46) STAT3STAT1TERTPTGS2
SCHEMBL29395084 0.82 STAT3 (0.50) STAT3STAT1TERTHTR1AHTR1D
SCHEMBL585368 0.81 STAT3 (0.45) STAT3STAT1TERTPTGS2
SCHEMBL28879055 0.81 STAT3 (0.49) STAT3STAT1TERTHTR1AHTR1D
SCHEMBL17419215 0.80 STAT3 (0.43) STAT3STAT1S1PR4S1PR1S1PR5
SCHEMBL14459908 0.80 STAT3 (0.42) STAT3STAT1TERTS1PR4S1PR1
SCHEMBL7262704 0.79 STAT3 (0.50) STAT3STAT1TERTTOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9076972-B2 Soluble porphyrin polymers ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2015-07-07 — — US disclosed
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