SCHEMBL9448765

SCHEMBL9448765

CCOC(=O)C(C)OC(=O)c1ccc(OC(C)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
ELANE P08246 3/20 0.49
LMNA P02545 3/20 0.46
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ESR1 P03372 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
ESR2 Q92731 1/20 0.42

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
SCHEMBL9448928 0.84 HSD17B10 (0.48) KMT2AELANELMNAALDH1A1SMN1; SMN2
SCHEMBL30876053 0.83 PDCD1 (0.53) KMT2ALMNAALDH1A1KDM4ENPC1
SCHEMBL1176935 0.82 CA12 (0.61) KMT2AELANELMNAALDH1A1KDM4E
SCHEMBL9448967 0.81 CA12 (0.66) KMT2ALMNAALDH1A1NPC1SMN1; SMN2
SCHEMBL9734838 0.81 CA12 (0.66) KMT2ALMNAALDH1A1NPC1SMN1; SMN2
SCHEMBL5789487 0.81 LMNA (0.58) KMT2AELANELMNAALDH1A1KDM4E
SCHEMBL5789486 0.81 LMNA (0.58) KMT2AELANELMNAALDH1A1KDM4E
SCHEMBL9590127 0.80 LMNA (0.67) KMT2ALMNAALDH1A1KDM4ENPC1
SCHEMBL9629230 0.80 ELANE (0.49) KMT2AELANELMNAALDH1A1SMN1; SMN2
SCHEMBL9458486 0.80 CA12 (0.46) KMT2ALMNAALDH1A1NPC1SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5243065-A Exhibit ferroelectricity; optoelectronics, display devices IDEMITSU KOSAN CO., LTD. (JP) 1993-09-07 US disclosed
EP-0362714-B1 LIQUID-CRYSTALLINE COMPOUNDS AND LIQUID-CRYSTALLINE POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-03-24 EP disclosed
US-5190687-A Polyepoxide or polyether polymers with ester groups that exhibit ferroelectricity with high speed response to electric fields IDEMITSU KOSAN CO., LTD. (JP) 1993-03-02 US disclosed
EP-0362714-A2 Liquid-crystalline compounds and liquid-crystalline polymers IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-04-11 EP disclosed