SCHEMBL25825991

SCHEMBL25825991

C=CC(=O)OCCNC(=O)Oc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
ELANE P08246 9/20 0.46
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
TAAR1 Q96RJ0 2/20 0.43
GAA P10253 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.41
PPARA Q07869 1/20 0.40
LSS P48449 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL16981272 0.90 THRB (0.59) THRBLMNATAAR1GAANPC1
SCHEMBL16875732 0.88 TSHR (0.46) THRBALDH1A1HPGDTAAR1GAA
SCHEMBL17350645 0.87 THRB (0.50) THRBTAAR1GAANPC1RAB9A
SCHEMBL13899162 0.87 THRB (0.56) THRBLMNATAAR1GAANPC1
SCHEMBL10327018 0.87 THRB (0.42) THRBALDH1A1HPGDTAAR1GAA
SCHEMBL13899155 0.85 THRB (0.57) THRBALDH1A1LMNATAAR1GAA
SCHEMBL13899201 0.85 THRB (0.54) THRBLMNATAAR1GAANPC1
SCHEMBL25825873 0.84 MGLL (0.35) THRBELANEALDH1A1LMNAHPGD
SCHEMBL19215617 0.83 SMN1; SMN2 (0.60) THRBALDH1A1LMNAGAANPC1
SCHEMBL12038757 0.83 THRB (0.43) THRBALDH1A1HPGDTAAR1GAA

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-2023123747-A1 HYDROGEN ABSTRACTION PHOTOINITIATOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 广州鹿山光电材料有限公司 2023-07-06 WO disclosed