SCHEMBL14877879

SCHEMBL14877879

CC1CCC(C(=O)Oc2ccc(OC(=O)C3CCCCC3)cc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.70
▸ HTT P42858 2/20 0.70
▸ SMN1; SMN2 Q16637 1/20 0.70
▸ TDP1 Q9NUW8 1/20 0.70
▸ POLB P06746 2/20 0.60
▸ ELANE P08246 2/20 0.60
▸ MEN1 O00255 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ ATM Q13315 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HPGD P15428 5/20 0.51
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ GLA P06280 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ NPC1 O15118 1/20 0.44
▸ CASP3 P42574 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP7 Q9BQF6 1/20 0.44

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
SCHEMBL13135270 0.93 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL13135348 0.93 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL14877839 0.91 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL11294520 0.89 KMT2A (0.56) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL14864486 0.89 KMT2A (0.60) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL10574401 0.89 KMT2A (0.88) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL25500845 0.88 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL13135287 0.88 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL12834390 0.86 KMT2A (0.59) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL2741100 0.86 HTT (0.59) KMT2AHTTSMN1; SMN2TDP1POLB

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-8425988-B2 Polymerizable liquid crystal compound, polymerizable liquid crystal composition and anisotropic polymer JNC CORPORATION (JP) 2013-04-23 — — US disclosed
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