SCHEMBL14817283

SCHEMBL14817283

O=C(Oc1ccc(O)cc1)c1ccc(OC(=O)C2CCC3OC3C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.45
▸ KMT2A Q03164 9/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ POLB P06746 1/20 0.39
▸ MEN1 O00255 5/20 0.38
▸ MAPT P10636 3/20 0.38
▸ GAA P10253 1/20 0.37
▸ XBP1 P17861 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ SENP1 Q9P0U3 1/20 0.35
▸ PARP10 Q53GL7 1/20 0.35

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
SCHEMBL14817279 1.00 ELANE (0.45) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL14817249 0.92 KMT2A (0.49) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730866 0.86 ELANE (0.42) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730864 0.85 POLB (0.44) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730868 0.84 ELANE (0.40) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730865 0.84 MAPT (0.45) ELANEKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL14817298 0.84 KMT2A (0.44) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL14817295 0.81 ELANE (0.41) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730781 0.80 PRSS1 (0.39) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12730787 0.80 NPC1 (0.38) ELANEKMT2ASMN1; SMN2HTTTDP1

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-8404316-B2 Polymerizable liquid crystal compound and its polymer JNC CORPORATION (JP) 2013-03-26 — — US disclosed
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