SCHEMBL4124177

SCHEMBL4124177

COc1ccc(S(=O)(=O)N2CCCCC2CCOCC(=O)NC2CCC(c3ccccc3)(N(C)C)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
OPRM1 P35372 2/20 0.47
OPRL1 P41146 2/20 0.47
FKBP1A P62942 1/20 0.43
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
MMP7 P09237 1/20 0.43
MMP13 P45452 1/20 0.43
PAX8 Q06710 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
EPHX2 P34913 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BDKRB1 P46663 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
SCHEMBL492515 0.84 RAB9A (0.49) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL3797432 0.81 RAB9A (0.49) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL3408435 0.79 RAB9A (0.47) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL493175 0.79 RAB9A (0.58) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL492819 0.78 ALDH1A1 (0.47) RAB9ANPC1MMP1MMP3MMP7
SCHEMBL492750 0.78 NPC1 (0.52) RAB9ANPC1MMP1MMP3MMP7
SCHEMBL492935 0.77 NPC1 (0.46) RAB9ANPC1MMP1MMP3MMP7
SCHEMBL3413278 0.77 RAB9A (0.43) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL493720 0.76 RAB9A (0.46) RAB9ANPC1FKBP1AMMP1MMP3
SCHEMBL492986 0.75 RAB9A (0.49) RAB9ANPC1FKBP1AMMP1MMP3

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
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US claimed
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 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-20090253669-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 RAB9A 2485/4885NPC1 2399/4885OPRM1 2798/4885

“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.