SCHEMBL18625354

SCHEMBL18625354

O=C(O)c1ccc(-c2cccc(-c3ccc(OCc4ccccc4)cc3)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 5/20 0.77
▸ NR4A1 P22736 1/20 0.77
▸ NR4A3 Q92570 1/20 0.77
▸ SRD5A2 P31213 2/20 0.70
▸ PLA2G4B P0C869 1/20 0.67
▸ MRGPRX4 Q96LA9 1/20 0.66
▸ MCL1 Q07820 1/20 0.64
▸ PTGES O14684 2/20 0.64
▸ ALOX5 P09917 2/20 0.64
▸ RXRA P19793 1/20 0.63
▸ RXRB P28702 1/20 0.63
▸ RXRG P48443 1/20 0.63
▸ NR1H4 Q96RI1 1/20 0.62
▸ PTGER4 P35408 1/20 0.62
▸ PTGER3 P43115 1/20 0.62
▸ LTC4S Q16873 1/20 0.61
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ TSHR P16473 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59

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
SCHEMBL4949143 0.92 NR4A2 (0.90) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL7477872 0.91 MRGPRX4 (0.74) NR4A2NR4A1NR4A3SRD5A2MRGPRX4
SCHEMBL10459767 0.91 MRGPRX4 (0.79) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL1756343 0.91 NR4A2 (0.81) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL5582767 0.91 NR4A2 (0.81) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
Hydrochloric Acid SCHEMBL8378883 0.91 NR4A2 (0.87) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL17952637 0.88 NR4A2 (0.71) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL4059143 0.87 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL228477 0.87 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B
SCHEMBL6830467 0.87 NR4A2 (1.00) NR4A2NR4A1NR4A3SRD5A2PLA2G4B

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
EP-2990459-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2017-04-26 — — EP disclosed
US-9594283-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-03-14 — — US disclosed
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