SCHEMBL5468258

SCHEMBL5468258

O=S(=O)(Nc1ccc2ccccc2n1)N1CCCC(c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.43
USP5 P45974 1/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
HSD11B1 P28845 1/20 0.41
KDM4E B2RXH2 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
MCL1 Q07820 1/20 0.39
BCL2A1 Q16548 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38

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
SCHEMBL5474154 0.83 LMNA (0.58) ALDH1A1LMNAMAPK1HTTHSD11B1
SCHEMBL5471685 0.83 LMNA (0.58) ALDH1A1LMNAMAPK1HTTHSD11B1
SCHEMBL5471456 0.82 KDM4E (0.57) USP30USP5ALDH1A1LMNAMAPK1
SCHEMBL5487139 0.79 ALDH1A1 (0.40) USP30ALDH1A1LMNAMAPK1HTT
SCHEMBL5468378 0.79 USP5 (0.42) USP30USP5ALDH1A1LMNAMAPK1
SCHEMBL5473669 0.78 PDE10A (0.40) USP30ALDH1A1LMNAMAPK1HTT
SCHEMBL14581828 0.74 KDM4E (0.50) USP30ALDH1A1LMNAMAPK1HTT
SCHEMBL14581938 0.74 HSD11B1 (0.45) USP30USP5ALDH1A1LMNAMAPK1
SCHEMBL5468428 0.73 NPC1 (0.51) ALDH1A1LMNAMAPK1HTTKDM4E
SCHEMBL5474755 0.71 NPC1 (0.56) ALDH1A1LMNAMAPK1HTTKDM4E

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-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed
US-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed
US-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070027118-A1 Novel compounds of amino sulfonyl derivatives HSD11B1, HSD11B2, HSD17B11 USP30 2113/4885USP5 1916/4885ALDH1A1 74/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.