SCHEMBL14582149

SCHEMBL14582149

C=C(C)C(=O)OCCCN1/C(=C/C=C(\C#N)C(=O)OCCOC(=O)C(=C)C)Sc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.46
▸ MAPT P10636 8/20 0.46
▸ KMT2A Q03164 8/20 0.46
▸ USP2 O75604 5/20 0.46
▸ CRHBP P24387 3/20 0.46
▸ CRHR2 Q13324 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HPGD P15428 1/20 0.46
▸ IDE P14735 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ FNTA P49354 7/20 0.44
▸ FNTB P49356 7/20 0.44
▸ MAPK1 P28482 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PDF Q9HBH1 3/20 0.40
▸ OPRK1 P41145 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL14582207 0.95 MEN1 (0.46) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL14582169 0.92 MEN1 (0.42) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL14582172 0.82 FNTA (0.42) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL24390185 0.78 MAPT (0.70) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL13739496 0.77 MEN1 (0.42) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL14582147 0.76 PDF (0.47) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL24390187 0.75 FNTA (0.60) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL10036074 0.75 MAPT (0.61) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL24390194 0.74 MAPT (0.56) MEN1MAPTKMT2AUSP2CRHBP
SCHEMBL13739499 0.74 BCHE (0.43) MEN1MAPTKMT2AUSP2CRHBP

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
US-20070042295-A1 Optical data carrier comprising a polymeric network in the information layer LANXESS DEUTSCHLAND GMBH (DE) 2007-02-22 — — US disclosed
US-20070042295-A1 Optical data carrier comprising a polymeric network in the information layer LANXESS DEUTSCHLAND GMBH (DE) 2007-02-22 — — US disclosed
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