SCHEMBL6676779

SCHEMBL6676779

C[N+](C)(C)c1ccccc1C1=Cc2cc3ccc(cc4nc(cc5[nH]c(c(-c6ccccc6[N+](C)(C)C)c1n2)c(-c1ccccc1[N+](C)(C)C)c5-c1ccccc1[N+](C)(C)C)C=C4)[nH]3

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.30
▸ STAT1 P42224 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
SCHEMBL22389541 0.85 NPC1 (0.33) STAT3STAT1
SCHEMBL22389525 0.84 NPC1 (0.33) STAT3STAT1
SCHEMBL270828 0.82 MGAM (0.33) STAT3STAT1
SCHEMBL38285 0.82 NPC1 (0.33) STAT3STAT1
SCHEMBL22389540 0.82 STAT3 (0.32) STAT3STAT1
SCHEMBL22389542 0.82 KDM4E (0.33) STAT3STAT1
SCHEMBL19206252 0.82 ALDH1A1 (0.34) —
SCHEMBL22389559 0.81 KDM4E (0.32) STAT3STAT1
SCHEMBL21176660 0.81 MGAM (0.33) STAT3STAT1
SCHEMBL22389523 0.81 STAT3 (0.31) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0814336-B1 Reagents and methods for releasing and measuring lead from biological matrices BAYER AG (US) 2004-11-10 — — EP disclosed
US-5891736-A SENSITIVE QUANTITATIVE ANALYSIS BY MIXING BLOOD OR OTHER FLUID WITH ION EXTRACTING ACID AND SOLUBILIZING ALKALI METAL SALT HAVING ANION OF NITRATE, CHLORIDE, OR BROMIDE; FORMING ANALYZABLE SUPERNATANT AND RESIDUAL PRECIPITATE BAYER CORPORATION (US) 1999-04-06 — — US disclosed
EP-0814336-A2 Reagents and methods for releasing and measuring lead from biological matrices Bayer Corporation (US) 1997-12-29 — — EP disclosed
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