SCHEMBL9735650

SCHEMBL9735650

CS(=O)(=O)Oc1cccc(S(=O)(=O)N2CCC2)n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
HCAR1 Q9BXC0 1/20 0.39
ALDH1A1 P00352 3/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37

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
SCHEMBL9734509 0.98 HSD11B1 (0.42) HSD11B1SMN1; SMN2HCAR1ALDH1A1MEN1
SCHEMBL9734149 0.97 TSHR (0.42) HSD11B1SMN1; SMN2HCAR1ALDH1A1HTT
SCHEMBL9724526 0.89 HSD11B1 (0.46) HSD11B1SMN1; SMN2ALDH1A1POLBHTT
SCHEMBL9734258 0.89 L3MBTL1 (0.43) HSD11B1SMN1; SMN2TSHRLMNA
SCHEMBL9734248 0.80 CA1 (0.38) HSD11B1HCAR1
SCHEMBL9865854 0.76 HCAR1 (0.39) SMN1; SMN2HCAR1LMNA
SCHEMBL9865677 0.76 HCAR1 (0.36) HCAR1
SCHEMBL9733818 0.74 POLB (0.46) HSD11B1ALDH1A1POLBPKMTSHR
SCHEMBL9866318 0.73 ALDH1A1 (0.36) SMN1; SMN2HCAR1ALDH1A1HTTLMNA
SCHEMBL9866531 0.73 POLB (0.36) SMN1; SMN2HCAR1ALDH1A1POLBHTT

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-5137886-A Agriculture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-08-11 US claimed
US-5137886-A Agriculture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-08-11 US disclosed
EP-0433001-A1 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-19 EP disclosed