SCHEMBL17112278

SCHEMBL17112278

Clc1cccc(Cl)c1-c1c2nc(c(-c3c(Cl)cccc3Cl)c3ccc(cc4nc(cc5ccc1[nH]5)C=C4)[nH]3)C=C2

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.55
▸ STAT1 P42224 1/20 0.55
▸ GRIA1 P42261 1/20 0.34
▸ CACNG8 Q8WXS5 1/20 0.34
▸ TERT O14746 2/20 0.33
▸ TOP1 P11387 1/20 0.33
▸ CYCS P99999 3/20 0.32
▸ FFAR1 O14842 1/20 0.32
▸ GUSB P08236 1/20 0.32

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
SCHEMBL19407291 0.88 STAT3 (0.74) STAT3STAT1GRIA1CACNG8TERT
Acetic Acid SCHEMBL6280981 0.86 STAT3 (0.47) STAT3STAT1GRIA1CACNG8TOP1
SCHEMBL29693613 0.83 TERT (0.45) TERTTOP1CYCS
SCHEMBL37941 0.83 TERT (0.45) TERTTOP1CYCS
SCHEMBL6744593 0.83 STAT3 (0.55) STAT3STAT1FFAR1
SCHEMBL9764318 0.82 STAT3 (0.58) STAT3STAT1GUSB
SCHEMBL17112277 0.82 STAT3 (0.39) STAT3STAT1GRIA1CACNG8GUSB
SCHEMBL28365832 0.81 TERT (0.44) TERTTOP1CYCS
SCHEMBL28349025 0.81 TERT (0.44) TERTTOP1CYCS
SCHEMBL28507436 0.81 TERT (0.44) TERTTOP1CYCS

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
EP-3122756-A1 INORGANIC-ORGANIC HYBRID COMPOUND Karlsruher Institut für Technologie (DE) 2017-02-01 — — EP disclosed
WO-2015144282-A1 INORGANIC-ORGANIC HYBRID COMPOUND Karlsruher Institut für Technologie (DE) 2015-10-01 — — WO disclosed
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