SCHEMBL23635521

SCHEMBL23635521

C=C(CO)C(=O)OCCOc1ccc(-c2cc(OC(=O)C(=C)CO)c(-c3ccc(OCCOC(=O)C(=C)CO)cc3)cc2CCCCCCCCCC)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.40
▸ PTPN11 Q06124 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ SLCO1B3 Q9NPD5 1/20 0.38
▸ SLCO1B1 Q9Y6L6 1/20 0.38
▸ CNR2 P34972 6/20 0.38
▸ CNR1 P21554 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ NPC1 O15118 1/20 0.37

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
SCHEMBL20313681 1.00 RARB (0.40) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL20313691 0.96 PTPN11 (0.39) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19854474 0.96 NR5A1 (0.42) CNR2CNR1
SCHEMBL19855218 0.95 RARB (0.40) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19855265 0.89 TSHR (0.40) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL20313693 0.89 RARB (0.39) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19855194 0.88 PTPN11 (0.47) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19855202 0.88 PTPN11 (0.44) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19854384 0.87 RARB (0.44) RARBPTPN11TSHRMEN1ALDH1A1
SCHEMBL19855276 0.87 RARB (0.44) RARBPTPN11TSHRMEN1ALDH1A1

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
Send feedback