SCHEMBL16561518

SCHEMBL16561518

C#CCOc1ccc(Sc2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.51
▸ SCD O00767 1/20 0.49
▸ CYP19A1 P11511 2/20 0.48
▸ PPARA Q07869 2/20 0.48
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ SRD5A2 P31213 1/20 0.46
▸ LMNA P02545 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ MAOA P21397 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ ELANE P08246 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ LTA4H P09960 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNB4 P30926 1/20 0.43
▸ CHRNA3 P32297 1/20 0.43

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
SCHEMBL11529553 0.91 GAA (0.60) GAASCDCYP19A1PPARAL3MBTL1
SCHEMBL12517362 0.84 CYP19A1 (0.59) GAASCDCYP19A1PPARASRD5A2
SCHEMBL16701110 0.82 SRD5A2 (0.57) GAASCDCYP19A1SRD5A2MAPK1
SCHEMBL30640594 0.80 CYP19A1 (0.57) GAASCDCYP19A1PPARAL3MBTL1
SCHEMBL26673845 0.80 CYP19A1 (0.57) GAASCDCYP19A1PPARAL3MBTL1
SCHEMBL16561441 0.80 CYP19A1 (0.42) GAASCDCYP19A1PPARASMN1; SMN2
SCHEMBL12516200 0.79 CYP19A1 (0.54) GAASCDCYP19A1HTTSRD5A2
SCHEMBL16561514 0.78 SCD (0.55) GAASCDCYP19A1PPARAL3MBTL1
SCHEMBL17828242 0.78 ALDH1A1 (0.67) L3MBTL1ALDH1A1SMN1; SMN2SRD5A2LMNA
SCHEMBL17828245 0.78 ALDH1A1 (0.67) L3MBTL1ALDH1A1SMN1; SMN2SRD5A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015031927-A1 PHOTOINITIATOR DURST PHOTOTECHNIK DIGITAL TECHNOLOGY GMBH (AT) 2015-03-12 — — WO disclosed
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