SCHEMBL4601440

SCHEMBL4601440

O=S(=O)(Cc1ccccc1)NCCc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
MMP1 P03956 1/20 0.59
MMP2 P08253 1/20 0.59
MMP9 P14780 1/20 0.59
MMP8 P22894 1/20 0.59
MMP13 P45452 1/20 0.59
CYP19A1 P11511 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.57
TAAR1 Q96RJ0 1/20 0.54
HSD17B10 Q99714 1/20 0.54
PRMT1 Q99873 1/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.54
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
CYP3A4 P08684 1/20 0.53
GAA P10253 1/20 0.53

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
SCHEMBL15056013 0.89 SGMS1 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL4851833 0.89 ALDH1A1 (0.58) CYP19A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL10494698 0.89 PRMT1 (0.67) CA1CA2CYP19A1MEN1KMT2A
SCHEMBL5187216 0.89 CYP19A1 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL6803854 0.89 PRMT1 (0.67) CA1CA2CYP19A1MEN1KMT2A
SCHEMBL15672851 0.88 MEN1 (0.58) MEN1KMT2AL3MBTL1TAAR1HSD17B10
SCHEMBL10494715 0.87 ALDH1A1 (0.50) CA1CA2MMP1MMP2MMP9
SCHEMBL15754219 0.86 L3MBTL1 (0.64) MMP1MMP8MMP13MEN1KMT2A
SCHEMBL14719879 0.86 MEN1 (0.77) MEN1KMT2AL3MBTL1TAAR1HSD17B10
SCHEMBL6804800 0.84 MAPT (0.58) CA1CA2MEN1KMT2ATAAR1

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-20100292269-A1 BIR DOMAIN BINDING COMPOUNDS AEGERA THERAPEUTICS, INC. (CA) 2010-11-18 US disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 WO 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-20100292269-A1 BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC3, BIRC2 CA1 4164/4885CA2 3685/4885MMP1 2887/4885

“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.