SCHEMBL25858846

SCHEMBL25858846

COC(=O)C(C)C(=O)OC(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
HCAR2 Q8TDS4 1/20 0.51
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KLK7 P49862 2/20 0.43
LMNA P02545 1/20 0.43
LPAR1 Q92633 2/20 0.41
LPAR3 Q9UBY5 1/20 0.41
TP53 P04637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL16313673 0.83 KMT2A (0.50) KMT2AHCAR2PTGS1PTGS2MEN1
SCHEMBL27708803 0.83 KMT2A (0.53) KMT2AHCAR2PTGS1PTGS2ALDH1A1
SCHEMBL1838253 0.81 HCAR2 (0.58) KMT2AHCAR2PTGS1PTGS2ALDH1A1
SCHEMBL585318 0.81 HCAR2 (0.58) KMT2AHCAR2ALDH1A1KLK7LPAR1
SCHEMBL7161006 0.80 HCAR2 (0.53) KMT2AHCAR2PTGS1PTGS2ALDH1A1
SCHEMBL7284865 0.79 HCAR2 (0.56) KMT2AHCAR2ALDH1A1KLK7LMNA
SCHEMBL10254557 0.79 HCAR2 (0.56) KMT2AHCAR2PTGS1PTGS2ALDH1A1
SCHEMBL7284857 0.79 HCAR2 (0.56) KMT2AHCAR2ALDH1A1KLK7LMNA
SCHEMBL3883004 0.79 HCAR2 (0.56) KMT2AHCAR2ALDH1A1MEN1LPAR1
SCHEMBL19277737 0.79 HCAR2 (0.51) KMT2AHCAR2ALDH1A1MEN1LPAR1

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-20230229078-A1 CHEMICAL LIQUID SUPPLY METHOD AND PATTERN FORMING METHOD FUJIFILM CORPORATION (JP) 2023-07-20 US disclosed
CN-103342639-A Method for synthesizing 2-phenylcarboxylate NANTONG GOOD IDEA CHEMICAL TECHNOLOGY CO LTD 2013-10-09 CN disclosed