SCHEMBL18568355

SCHEMBL18568355

C=CC(=O)OC(CC)CCCCCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCCCCCC(CC)OC(=O)C=C)cc3)c(C)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
NPC1 O15118 3/20 0.40
LMNA P02545 3/20 0.40
NFKB1 P19838 3/20 0.40
NFKB2 Q00653 3/20 0.40
RELA Q04206 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PRSS1 P07477 1/20 0.36
ACR P10323 1/20 0.36
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
PPARG P37231 2/20 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
SCHEMBL14480400 0.96 KMT2A (0.41) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL14974134 0.94 NPC1 (0.46) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL14916545 0.94 NPC1 (0.43) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL30004969 0.94 NPC1 (0.46) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL17709490 0.94 NPC1 (0.46) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL13865616 0.91 MAPT (0.36) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL28881678 0.87 MAPT (0.39) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL30726798 0.87 KMT2A (0.41) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL5593505 0.87 KMT2A (0.41) MAPTNPC1LMNANFKB1NFKB2
SCHEMBL13719111 0.86 FAAH (0.42) MAPTNPC1LMNANFKB1NFKB2

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-9588391-B2 Liquid crystal panel, display device, and process for manufacturing liquid crystal panel BOE TECHNOLOGY GROUP CO., LTD. (CN) 2017-03-07 US disclosed