SCHEMBL10628554

SCHEMBL10628554

CN(C)S(=O)(=O)c1ccc(OC(=S)Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
LMNA P02545 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
HTT P42858 1/20 0.59
MAPT P10636 3/20 0.53
NPY2R P49146 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41

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
SCHEMBL3729302 0.79 MAPT (0.67) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL11771545 0.77 RAB9A (0.68) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL9692767 0.76 LMNA (0.69) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL30259514 0.75 ELANE (0.70) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL691734 0.74 ALDH1A1 (0.73) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL3275099 0.73 ALDH1A1 (0.56) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL27996799 0.72 ALDH1A1 (0.59) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL27877398 0.71 ALDH1A1 (0.63) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL119176 0.71 LMNA (1.00) ALDH1A1LMNASMN1; SMN2HTTMAPT
SCHEMBL23651810 0.71 MAPT (0.76) ALDH1A1LMNASMN1; SMN2HTTMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4772692-A AZETIDINONES HOECHST UK LIMITED (GB) 1988-09-20 US disclosed
EP-0069377-B1 ANTIBACTERIAL PENEM DERIVATIVES HOECHST UK LIMITED (GB) 1988-06-22 EP disclosed
US-4585767-A ANTIBIOTICS, BETA-LACTAMASE INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1986-04-29 US disclosed
EP-0069377-A2 Antibacterial penem derivatives HOECHST UK LIMITED (GB) 1983-01-12 EP disclosed