SCHEMBL14817249

SCHEMBL14817249

O=C(Oc1ccc(O)cc1)C1CCC2OC2C1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.49
▸ HTT P42858 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ ELANE P08246 2/20 0.44
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ GAA P10253 3/20 0.42
▸ XBP1 P17861 1/20 0.42
▸ POLB P06746 2/20 0.39
▸ P4HB P07237 1/20 0.38
▸ HPGD P15428 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ BLM P54132 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ F2 P00734 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ GLA P06280 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
SCHEMBL14817283 0.92 ELANE (0.45) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL14817279 0.92 ELANE (0.45) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL14817298 0.91 KMT2A (0.44) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL26261372 0.86 ELANE (0.53) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL22261439 0.83 TDP1 (0.44) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL14505071 0.82 KMT2A (0.46) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL19000887 0.82 KMT2A (0.70) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL20045190 0.82 KMT2A (0.70) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL27694951 0.82 KMT2A (0.70) KMT2AHTTTDP1SMN1; SMN2ELANE
SCHEMBL4544901 0.82 KMT2A (0.70) KMT2AHTTTDP1SMN1; SMN2ELANE

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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