SCHEMBL9734258

SCHEMBL9734258

CS(=O)(=O)Oc1cccc(S(=O)(=O)N2CCSCC2)n1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
HSD11B1 P28845 12/20 0.40
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9735650 0.89 HSD11B1 (0.43) HSD11B1LMNATSHRSMN1; SMN2
SCHEMBL9734509 0.87 HSD11B1 (0.42) HSD11B1LMNATSHRSMN1; SMN2
SCHEMBL9734149 0.86 TSHR (0.42) HSD11B1LMNATSHRSMN1; SMN2
SCHEMBL9724526 0.84 HSD11B1 (0.46) L3MBTL1HSD11B1LMNATSHRSMN1; SMN2
SCHEMBL9734308 0.76 TSHR (0.41) L3MBTL1HSD11B1LMNATSHR
SCHEMBL9734248 0.76 CA1 (0.38) HSD11B1
SCHEMBL9865854 0.72 HCAR1 (0.39) LMNASMN1; SMN2
SCHEMBL9865677 0.71 HCAR1 (0.36)
SCHEMBL9866318 0.69 ALDH1A1 (0.36) L3MBTL1LMNASMN1; SMN2
SCHEMBL10745662 0.69 TXNRD1 (0.34)

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