SCHEMBL9212019

SCHEMBL9212019

CCCC(CC)N(NC(=O)c1ccc2cc(OC(C)=O)ccc2c1)C(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
MTNR1A P48039 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL9202013 0.80 THRA (0.48)
SCHEMBL9212008 0.80 ELANE (0.41) ELANEPPARGPPARASMN1; SMN2MAPT
SCHEMBL9211999 0.71 HDAC3 (0.42) PPARGPPARASMN1; SMN2ALDH1A1MEN1
SCHEMBL9825038 0.68 POLB (0.50) ALDH1A1LMNARAB9AHPGDHDAC1
SCHEMBL14010834 0.66 L3MBTL1 (0.56) SMN1; SMN2NPC1RAB9AHPGDKMT2A
SCHEMBL14010836 0.66 L3MBTL1 (0.56) SMN1; SMN2NPC1RAB9AHPGDKMT2A
SCHEMBL165545 0.66 L3MBTL1 (0.48) SMN1; SMN2LMNAMAPTNPC1RAB9A
SCHEMBL19955336 0.65 ABCB1 (0.44) NPC1RAB9AMEN1KMT2AHDAC3
SCHEMBL2683319 0.65 ABCB1 (0.44) NPC1RAB9AMEN1KMT2AHDAC3
SCHEMBL908522 0.65 KDM4E (0.68) ELANEALDH1A1LMNAMAPTMAPK1

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
EP-0415256-B1 Mesomorphic compound, liquid crystal composition containing same and liquid crystal device using same CANON KK (JP) 1995-11-02 EP disclosed
US-5091109-A Ferroelectric; improved responsiveness CANON KABUSHIKI KAISHA (JP) 1992-02-25 US disclosed
EP-0415256-A2 Mesomorphic compound, liquid crystal composition containing same and liquid crystal device using same CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP disclosed