SCHEMBL19308216

SCHEMBL19308216

O=C(C1CCC(S(=O)(=O)c2ccc(C3CCCCC3)cc2)CC1)N1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.49
▸ CHRNA3 P32297 1/20 0.49
▸ CHRNA4 P43681 1/20 0.49
▸ CHRNB3 Q05901 1/20 0.49
▸ CHRNA6 Q15825 1/20 0.49
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ F2 P00734 1/20 0.44
▸ F10 P00742 1/20 0.44
▸ PLG P00747 1/20 0.44
▸ PLAU P00749 1/20 0.44
▸ ST14 Q9Y5Y6 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CNR1 P21554 2/20 0.40
▸ APOBEC3A P31941 1/20 0.40
▸ APOBEC3G Q9HC16 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40

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
SCHEMBL19308218 0.91 LMNA (0.44) LMNAHTTF2F10PLG
SCHEMBL19308210 0.84 F2 (0.48) LMNAHTTF2F10PLG
SCHEMBL12929565 0.81 CHRNB2 (0.43) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL19308219 0.80 F2 (0.46) LMNAHTTF2F10PLG
SCHEMBL19308217 0.79 LMNA (0.50) LMNAHTTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL12929570 0.76 NPSR1 (0.43) LMNAHTTF2F10PLG
SCHEMBL19308211 0.72 LMNA (0.49) LMNAHTTF2F10PLG
SCHEMBL16026452 0.72 LMNA (0.77) LMNAHTTSMN1; SMN2NPSR1ALDH1A1
SCHEMBL22672736 0.72 CHRNB2 (0.80) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL22672737 0.72 CHRNB2 (0.80) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6

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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