SCHEMBL26103041

SCHEMBL26103041

C=CC(=O)Oc1ccccc1C(C)c1cc(C(C)(C)CC)cc(C(C)(C)CC)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.38
▸ THRA P10827 1/20 0.38
▸ MAPK1 P28482 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ELANE P08246 1/20 0.32
▸ RARG P13631 1/20 0.31
▸ RXRA P19793 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CASP3 P42574 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
SCHEMBL29994023 1.00 THRB (0.38) THRBTHRAMAPK1SMN1; SMN2CYP1A2
SCHEMBL28745620 0.91 MAPK1 (0.42) THRBTHRAMAPK1SMN1; SMN2CYP1A2
SCHEMBL28745621 0.87 RXRA (0.32) THRBMAPK1SMN1; SMN2CYP1A2CYP3A4
Phenol SCHEMBL7639405 0.85 RXRA (0.35) MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2C9
SCHEMBL29464292 0.85 RXRA (0.37) THRBMAPK1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL28198448 0.85 CYP3A4 (0.44) THRBTHRACYP1A2CYP3A4CYP2C9
SCHEMBL237192 0.85 RXRA (0.37) THRBMAPK1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL29353638 0.85 RXRA (0.37) THRBMAPK1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL16280978 0.83 RXRA (0.34) MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2C9
SCHEMBL28797268 0.83 THRB (0.44) THRBTHRAMAPK1SMN1; SMN2MEN1

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
WO-2023074504-A1 RESIN COMPOSITION AND OPTICAL ELEMENT 日本ゼオン株式会社 2023-05-04 — — WO disclosed
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