SCHEMBL27658967

SCHEMBL27658967

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.O=[Ti]

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.39
▸ STAT1 P42224 1/20 0.39

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
SCHEMBL29430977 0.93 STAT3 (0.42) STAT3STAT1
SCHEMBL6744970 0.93 STAT3 (0.42) STAT3STAT1
SCHEMBL30821407 0.93 STAT3 (0.42) STAT3STAT1
Formaldehyde SCHEMBL27704074 0.91 STAT3 (0.39) STAT3STAT1
SCHEMBL28954232 0.91 STAT3 (0.39) STAT3STAT1
Formaldehyde SCHEMBL28139016 0.91 STAT3 (0.39) STAT3STAT1
SCHEMBL9404765 0.91 STAT3 (0.39) STAT3STAT1
SCHEMBL9718830 0.91 STAT3 (0.39) STAT3STAT1
SCHEMBL1629005 0.91 STAT3 (0.39) STAT3STAT1
SCHEMBL7866625 0.90 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110548141-A Preparation method and application of titanyl porphyrin complex-folic acid liposome nanoparticles UNIV GUANGDONG MEDICAL 2019-12-10 — — CN disclosed
CN-100556874-C Process for producing xylitol PURDUE RESEARCH FOUNDATION (US) 2009-11-04 — — CN disclosed
CN-1950317-A Processes for the production of xylitol PURDUE RESEARCH FOUNDATION (US) 2007-04-18 — — CN disclosed
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