SCHEMBL25261069

SCHEMBL25261069

Cc1ccccc1S(=O)(=O)N1CCCC(C(N)=O)C1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.53
GAA P10253 1/20 0.53
CYP2C19 P33261 1/20 0.51
HSD11B1 P28845 1/20 0.51
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 2/20 0.50
HTT P42858 2/20 0.50
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
LMNA P02545 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
SCHEMBL5243760 0.88 KMT2A (0.61) EPHX2GAACYP2C19KMT2ASMN1; SMN2
SCHEMBL5243710 0.83 EPHX2 (0.77) EPHX2HSD11B1KMT2AALDH1A1MEN1
SCHEMBL4964697 0.82 CNR1 (0.61) EPHX2KMT2AMEN1KDM4E
SCHEMBL613101 0.82 EPHX2 (0.79) EPHX2HSD11B1KMT2AALDH1A1MEN1
SCHEMBL24781397 0.81 KMT2A (0.57) KMT2AALDH1A1MEN1HTTPOLB
SCHEMBL24781390 0.81 KMT2A (0.57) KMT2AALDH1A1MEN1HTTPOLB
SCHEMBL24781392 0.81 KMT2A (0.57) KMT2AALDH1A1MEN1HTTPOLB
SCHEMBL21670262 0.81 LMNA (0.70) CYP2C19ALDH1A1HTTSMN1; SMN2TSHR
SCHEMBL612150 0.80 EPHX2 (0.66) EPHX2GAAHSD11B1KMT2AALDH1A1
SCHEMBL612149 0.80 EPHX2 (0.66) EPHX2GAAHSD11B1KMT2AALDH1A1

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
EP-4192816-A1 COMPOUNDS AS C5AR INHIBITORS Kira Pharmaceuticals (Suzhou) Ltd. (CN) 2023-06-14 EP disclosed