SCHEMBL28698785

SCHEMBL28698785

N#Cc1ccc(-c2cs[c]n2)cc1S(=O)(=O)N1CCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ GBA1 P04062 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ BRD4 O60885 2/20 0.34
▸ BRD2 P25440 2/20 0.34
▸ BRD3 Q15059 2/20 0.34
▸ HSD11B1 P28845 2/20 0.34
▸ ALOX5AP P20292 1/20 0.34

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
SCHEMBL2751692 0.75 ALDH1A1 (0.43) CYP11B1CYP11B2NPSR1LMNAALDH1A1
SCHEMBL17626273 0.73 ALDH1A1 (0.58) PKMNPSR1LMNASMN1; SMN2ALDH1A1
SCHEMBL17626079 0.72 ALDH1A1 (0.60) PKMNPSR1LMNASMN1; SMN2ALDH1A1
SCHEMBL12778129 0.69 KDM4E (0.56) TDO2PKMSMN1; SMN2ALDH1A1KDM4E
SCHEMBL12778097 0.68 KDM4E (0.58) TDO2PKMSMN1; SMN2ALDH1A1KDM4E
SCHEMBL12778084 0.68 KDM4E (0.58) TDO2PKMSMN1; SMN2ALDH1A1KDM4E
SCHEMBL17626001 0.65 KMT2A (0.57) NPSR1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1014809 0.65 PKM (0.67) PKMSMN1; SMN2ALDH1A1KDM4EATM
SCHEMBL1433870 0.65 GAA (0.49) CYP11B2KDM4ERAB9A
SCHEMBL17626057 0.64 CYP11B1 (0.39) CYP11B1CYP11B2LMNAALDH1A1KDM4E

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
CN-114072390-A RAD51 inhibitors 赛泰尔治疗公司 2022-02-18 — — CN disclosed
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