SCHEMBL8997264

SCHEMBL8997264

Cc1cccc(-c2ccccc2S(=O)(=O)NC(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.47
CNR2 P34972 3/20 0.47
NAMPT P43490 2/20 0.46
CASP1 P29466 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CNR1 P21554 2/20 0.43
EDNRB P24530 3/20 0.43
EDNRA P25101 3/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KAT6A Q92794 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
APAF1 O14727 1/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL8240985 0.87 CASP1 (0.56) MCL1CASP1EDNRBEDNRAMEN1
SCHEMBL8997298 0.84 NAT1 (0.50) MCL1NAMPTCASP1EDNRBEDNRA
SCHEMBL8997316 0.84 KAT6A (0.47) CASP1KAT6AGAA
SCHEMBL3884580 0.81 CNR2 (0.44) MCL1CNR2NAMPTL3MBTL1CNR1
SCHEMBL5681328 0.78 CASP1 (0.78) MCL1NAMPTCASP1L3MBTL1
SCHEMBL19475077 0.78 ALOX5AP (0.46) CNR2NAMPTCNR1ALDH1A1MAPT
SCHEMBL5679414 0.78 NPC1 (0.44) CNR2NAMPTL3MBTL1CNR1ALDH1A1
SCHEMBL5147607 0.78 CASP1 (0.54) CASP1EDNRBEDNRAKDM4ETDP1
SCHEMBL29894177 0.77 NAMPT (0.41) NAMPTEDNRBEDNRAALDH1A1KMT2A
Biphenyl SCHEMBL9178383 0.76 SLC1A3 (0.51) L3MBTL1POLBALDH1A1HPGDKAT6A

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-5512681-A HORMONE INHIBITORS FOR TREATMENT OF HYPERTENSION OR CONGESTIVE HEART FAILURE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-30 US disclosed