SCHEMBL2364685

SCHEMBL2364685

CCN1c2ccccc2SC1NC1Sc2ccccc2N1CC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ BCHE P06276 3/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAOA P21397 1/20 0.34
▸ KDM1A O60341 2/20 0.34
▸ PPARG P37231 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL30702419 0.78 SMN1; SMN2 (0.38) GSK3BSMN1; SMN2ALDH1A1BCHEMAOA
SCHEMBL1046284 0.78 SMN1; SMN2 (0.38) GSK3BSMN1; SMN2ALDH1A1BCHEMAOA
SCHEMBL11579381 0.77 PDGFRB (0.39) GSK3BSMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL2748081 0.76 ALDH1A1 (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEGAA
SCHEMBL31571120 0.76 ALDH1A1 (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEGAA
SCHEMBL1573679 0.76 PPARG (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEMAPT
SCHEMBL29973993 0.76 ALDH1A1 (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEMAOA
Iodide SCHEMBL8924984 0.76 SMN1; SMN2 (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEMAOA
SCHEMBL9305366 0.76 ALDH1A1 (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEGAA
SCHEMBL1412788 0.76 PPARG (0.37) GSK3BSMN1; SMN2ALDH1A1BCHEGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005054800-A1 FREEZE THAW INDICATOR CHROMA CHEM PTY LTD (AU) 2005-06-16 — — WO claimed
EP-2078197-B1 HAPTENS, HAPTEN CONJUGATES, COMPOSITIONS THEREOF AND METHOD FOR THEIR PREPARATION AND USE VENTANA MED SYST INC (US) 2016-03-23 — — EP disclosed
EP-2442107-B1 Haptens, hapten conjugates, compositions thereof and method for their preparation and use VENTANA MED SYST INC (US) 2014-03-12 — — EP disclosed
WO-2011104267-A1 METHOD FOR DETERMINING THE ANTIOXIDANT POWER OF BIOLOGICAL AND VEGETAL FLUIDS COR.CON. INTERNATIONAL S.R.L. (IT) 2011-09-01 — — WO disclosed
EP-2362227-A1 Method for determining the antioxidant power of biological and vegetal fluids Cor.Con. International S.r.L. (IT) 2011-08-31 — — EP disclosed
WO-1992001046-A1 LACCASE PRODUCTION BY RECOMBINANT ORGANISMS VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 1992-01-23 — — WO disclosed
EP-0396434-A1 Compositions with cytolytic properties specific for appropriate target cells and their use IDEON CORPORATION (US) 1990-11-07 — — EP disclosed
EP-0302011-A2 Monoclonal antibodies and process for the diagnosis of phytophtora infections CIBA-GEIGY AG (CH) 1989-02-01 — — EP disclosed
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