SCHEMBL19308211

SCHEMBL19308211

N=C(N)N1CCC(S(=O)(=O)c2ccc(C3CCCCC3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ F2 P00734 3/20 0.48
▸ F10 P00742 3/20 0.48
▸ PLG P00747 3/20 0.48
▸ PLAU P00749 3/20 0.48
▸ ST14 Q9Y5Y6 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ APOBEC3A P31941 1/20 0.44
▸ APOBEC3G Q9HC16 1/20 0.44
▸ TSHR P16473 2/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39

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
SCHEMBL19308219 0.92 F2 (0.46) LMNAHTTF2F10PLG
SCHEMBL19308210 0.87 F2 (0.48) LMNAHTTF2F10PLG
SCHEMBL19308220 0.86 F2 (0.44) LMNAHTTF2F10PLG
SCHEMBL13222794 0.79 F2 (0.48) LMNAHTTF2F10PLG
SCHEMBL19308218 0.77 LMNA (0.44) LMNAHTTF2F10PLG
SCHEMBL12929569 0.74 F2 (0.45) LMNAHTTF2F10PLG
SCHEMBL19308206 0.73 F2 (0.38) LMNAHTTF2F10PLG
SCHEMBL19308217 0.73 LMNA (0.50) LMNAHTTSMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL12929559 0.73 F2 (0.46) LMNAHTTF2F10PLG
SCHEMBL25296022 0.72 LMNA (0.43) LMNAHTTSMN1; SMN2APOBEC3AAPOBEC3G

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
US-9752149-B2 Matriptase inhibitors and uses thereof against orthomyxoviridae infections SOCPRA Sciences Sante et Humaines S.E.C. (CA) 2017-09-05 — — US disclosed
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