SCHEMBL16900164

SCHEMBL16900164

COc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(-n2c3ccccc3c3ccccc32)cc1CO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ BAZ2B Q9UIF8 1/20 0.42
▸ BAZ2A Q9UIF9 1/20 0.42
▸ DRD2 P14416 1/20 0.39
▸ DRD4 P21917 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37

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
SCHEMBL10100811 0.89 KDM4E (0.47) SMN1; SMN2MAPK1KMT2AALDH1A1MEN1
SCHEMBL18209347 0.78 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1FGFR1KMT2ALMNA
SCHEMBL12113728 0.76 KDM4E (0.47) MAPK1KMT2AALDH1A1MEN1LMNA
SCHEMBL28001656 0.74 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1KMT2AALDH1A1MEN1
SCHEMBL16521616 0.74 IDO1 (0.47) SMN1; SMN2MAPK1KMT2AALDH1A1MEN1
SCHEMBL18771314 0.73 FGFR1 (0.38) SMN1; SMN2MAPK1FGFR1SRCKMT2A
SCHEMBL21666814 0.73 ACACA (0.52) SMN1; SMN2MAPK1KMT2AALDH1A1MEN1
SCHEMBL14039032 0.73 ENPP2 (0.49) SMN1; SMN2MAPK1KMT2AALDH1A1MEN1
SCHEMBL14648914 0.72 SMN1; SMN2 (0.44) SMN1; SMN2MAPK1KMT2AALDH1A1LMNA
SCHEMBL23257790 0.72 KDM4E (0.46) ALDH1A1LMNAKDM4EATML3MBTL1

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
US-9082996-B2 Organic electroluminescent element, display device and lighting device Konica Minolta, Inc. (JP) 2015-07-14 — — US disclosed
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