SCHEMBL19855408

SCHEMBL19855408

C=C(CO)C(=O)OCCCC(CCCOC(=O)C(=C)CO)c1ccc(C2CCC(C3CCC(C4CCC(CCCCC)CC4)CC3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ACACB O00763 2/20 0.32
▸ RAB9A P51151 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTGER2 P43116 8/20 0.31
▸ PTGER4 P35408 2/20 0.31
▸ PTGER3 P43115 2/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ TSHR P16473 2/20 0.30
▸ SPHK1 Q9NYA1 1/20 0.30

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
SCHEMBL19855045 0.97 CYP2C9 (0.41) CYP2C9ALDH1A1LMNAMAPTACACB
SCHEMBL19855707 0.96 TSHR (0.37) CYP2C9ALDH1A1LMNAMAPTACACB
SCHEMBL19856079 0.94 TSHR (0.39) CYP2C9ALDH1A1LMNAMAPTACACB
SCHEMBL19855186 0.92 CYP2C9 (0.37) CYP2C9ALDH1A1LMNAMAPTSPHK1
SCHEMBL20882392 0.91 TSHR (0.41) CYP2C9ALDH1A1LMNAMAPTRAB9A
SCHEMBL19722361 0.90 CYP2C9 (0.42) CYP2C9ALDH1A1LMNAMAPTRAB9A
SCHEMBL20882753 0.90 CYP2C9 (0.35) CYP2C9ALDH1A1LMNAMAPTRAB9A
SCHEMBL20882387 0.90 CYP2C9 (0.37) CYP2C9ALDH1A1LMNAMAPTRAB9A
SCHEMBL19855658 0.90 CYP2C9 (0.38) CYP2C9ALDH1A1LMNAMAPTACACB
SCHEMBL19856354 0.89 TSHR (0.38) CYP2C9ALDH1A1LMNAMAPTRAB9A

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
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO disclosed
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