SCHEMBL4960132

SCHEMBL4960132

O=S(=O)(NI)N1CCC(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.57
▸ MMP2 P08253 1/20 0.50
▸ MMP13 P45452 1/20 0.50
▸ HSD11B1 P28845 2/20 0.48
▸ USP5 P45974 6/20 0.46
▸ MMP3 P08254 2/20 0.46
▸ LMNA P02545 2/20 0.45
▸ TSHR P16473 2/20 0.45
▸ STAT3 P40763 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ MCOLN2 Q8IZK6 1/20 0.45
▸ MCOLN3 Q8TDD5 1/20 0.45
▸ MCOLN1 Q9GZU1 1/20 0.45
▸ MCL1 Q07820 1/20 0.44
▸ BCL2A1 Q16548 1/20 0.44
▸ SLC18A3 Q16572 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43

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
SCHEMBL26213661 0.79 HSD11B1 (0.52) USP30MMP2MMP13HSD11B1USP5
SCHEMBL4960919 0.79 CA12 (0.54) USP30MMP2MMP13HSD11B1USP5
SCHEMBL27582496 0.78 MMP2 (0.52) USP30MMP2MMP13HSD11B1USP5
SCHEMBL9320214 0.77 NPY5R (0.58) USP30MMP2MMP13HSD11B1USP5
SCHEMBL21033833 0.77 HSD11B1 (0.51) USP30MMP2MMP13HSD11B1USP5
SCHEMBL4964431 0.77 MMP2 (0.54) USP30MMP2MMP13HSD11B1USP5
SCHEMBL31527727 0.77 CA12 (0.56) USP30MMP2MMP13HSD11B1USP5
SCHEMBL26213675 0.77 USP30 (0.51) USP30MMP2MMP13HSD11B1USP5
SCHEMBL1983277 0.72 HPGD (0.63) TSHRALDH1A1KMT2A
SCHEMBL30683332 0.71 KDM1A (0.51) USP30MMP2MMP13HSD11B1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1881959-A1 PROCESS FOR PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2008-01-30 — — EP disclosed
WO-2006127184-A1 PROCESS FOR PREPARATION OF SULFAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2006-11-30 — — WO disclosed
Send feedback