SCHEMBL28259696

SCHEMBL28259696

O=CCCOc1ccc(OC(=O)c2ccc(OCCC=O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.51
▸ LMNA P02545 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ PRSS1 P07477 2/20 0.50
▸ ACR P10323 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ KMT2A Q03164 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ RAB9A P51151 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ PARP10 Q53GL7 1/20 0.45

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
SCHEMBL28259695 0.94 MAPT (0.56) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL13806837 0.85 L3MBTL1 (0.59) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL28258061 0.82 ALDH1A1 (0.65) HSD17B10L3MBTL1ALDH1A1TSHRPKM
SCHEMBL14226876 0.81 L3MBTL1 (0.70) MAPTLMNARAB9AL3MBTL1ALDH1A1
SCHEMBL2552642 0.81 PARP10 (0.64) PRSS1KMT2AALDH1A1PARP10
SCHEMBL13146702 0.80 L3MBTL1 (0.71) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL8913028 0.80 L3MBTL1 (0.61) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL25867841 0.79 L3MBTL1 (0.65) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL8572744 0.79 L3MBTL1 (0.65) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL11646532 0.79 LMNA (0.74) MAPTLMNANPC1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110235055-A Liquid crystal alignment film and liquid crystal display device using the same 株式会社LG化学 2019-09-13 — — CN disclosed
CN-108885375-A Liquid crystal alignment film, method for preparing the same, and liquid crystal display device using the same 株式会社LG化学 2018-11-23 — — CN disclosed
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