SCHEMBL11473046

SCHEMBL11473046

Cc1ccc(S(=O)(=O)NCc2ccccc2CC(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.67
▸ KMT2A Q03164 1/20 0.67
▸ CA12 O43570 1/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ ATM Q13315 1/20 0.61
▸ CA9 Q16790 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ CYP19A1 P11511 1/20 0.52
▸ ALDH1A1 P00352 5/20 0.50
▸ GAA P10253 2/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ LMNA P02545 4/20 0.49
▸ MAPT P10636 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ HPGD P15428 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ HTT P42858 1/20 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
SCHEMBL11485588 0.84 MEN1 (0.50) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL29048576 0.81 MEN1 (0.72) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL12406975 0.80 KMT2A (1.00) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL7866143 0.80 LMNA (0.59) MEN1KMT2ACA12CA9L3MBTL1
SCHEMBL20981435 0.78 MEN1 (0.63) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL29128000 0.78 KMT2A (0.72) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL5960083 0.78 KMT2A (0.72) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL7521985 0.78 KMT2A (0.72) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL29540801 0.78 KEAP1 (0.70) MEN1KMT2ACA12CYP1A2CYP3A4
SCHEMBL12945183 0.77 KMT2A (0.67) MEN1KMT2ACA12CYP1A2CYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4198506-A INTERMEDIATES FOR THE CORRESPONDING 3-SUBSTITUTED 3-CEPHEM-4-CARBOXYLIC ACIDS BRISTOL-MYERS COMPANY (US) 1980-04-15 — — US disclosed
US-4151352-A CEPHALOSPORINS, BACTERICIDES BRISTOL-MYERS COMPANY (US) 1979-04-24 — — US disclosed
US-4082912-A ANTIBACTERIAL BRISTOL-MYERS COMPANY (US) 1978-04-04 — — US disclosed
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