SCHEMBL7734598

SCHEMBL7734598

COC(=O)c1ccccc1C(=O)c1ccc(N(C)C)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ LMNA P02545 3/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HPGD P15428 3/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ PGR P06401 2/20 0.49
▸ SLC6A2 P23975 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ AR P10275 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TBXA2R P21731 1/20 0.49
▸ ADRA1A P35348 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.48

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
SCHEMBL16687946 0.87 KMT2A (0.57) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL3165135 0.86 CA12 (0.62) SMN1; SMN2KMT2AMEN1LMNATSHR
SCHEMBL1959291 0.85 SMN1; SMN2 (0.74) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL22938966 0.85 HPGD (0.57) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL6205557 0.84 KMT2A (0.72) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL29570529 0.84 KMT2A (0.72) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL16340374 0.83 MEN1 (0.54) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL22939649 0.83 ALDH1A1 (0.64) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL4735417 0.81 GAA (0.76) SMN1; SMN2KMT2AMEN1L3MBTL1LMNA
SCHEMBL8762164 0.80 CA12 (0.47) SMN1; SMN2KMT2AMEN1LMNATSHR

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-6409995-B1 SUNSCREEN BASF AKTIENGESELLSCHAFT (DE) 2002-06-25 — — US disclosed
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