SCHEMBL302189

SCHEMBL302189

O=S(=O)(OCCO)c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.42
MMP1 P03956 2/20 0.42
MMP8 P22894 2/20 0.42
MMP13 P45452 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
MMP9 P14780 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
F2 P00734 2/20 0.39
PRSS1 P07477 2/20 0.39
PRSS2 P07478 2/20 0.39
PRSS3 P35030 2/20 0.39
SOS1 Q07889 1/20 0.39
ESR2 Q92731 2/20 0.39
MMP7 P09237 1/20 0.39
MMP12 P39900 1/20 0.39
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
CYP3A4 P08684 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
SCHEMBL15000837 0.88 MEN1 (0.46) MMP2MMP1MMP8MMP13CA1
SCHEMBL1844913 0.86 MEN1 (0.42) MMP2MMP1MMP8MMP13CA1
SCHEMBL19809912 0.81 L3MBTL1 (0.45) MMP2MMP1MMP8MMP13CA1
SCHEMBL27852260 0.81 TSHR (0.47) MMP2MMP1MMP8MMP13CA1
SCHEMBL1258986 0.81 STAT3 (0.47) MMP2MMP1MMP8MMP13CA1
SCHEMBL29259800 0.81 NPC1 (0.46) MMP2MMP1MMP8MMP13CA1
SCHEMBL11249350 0.81 PLCG1 (0.45) MMP2MMP1MMP8MMP13CA1
SCHEMBL30555660 0.80 PARL (0.44) MMP2MMP1MMP8MMP13CA1
SCHEMBL3447513 0.80 PARL (0.44) MMP2MMP1MMP8MMP13CA1
SCHEMBL6114697 0.79 MEN1 (0.46) MMP2MMP1MMP8MMP13CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2012500804-A 2012-01-12 JP claimed
EP-2328619-A2 POLYMERIC BENZYL CARBONATE-DERIVATIVES Baxter International Inc. (US) 2011-06-08 EP claimed
WO-2010022320-A2 POLYMERIC BENZYL CARBONATE-DERIVATIVES BAXTER INTERNATIONAL INC. (US) 2010-02-25 WO claimed
US-20100048483-A1 POLYMERIC BENZYL CARBONATE-DERIVATIVES BAXTER HEALTHCARE S.A. (CH) 2010-02-25 US claimed

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-20100048483-A1 POLYMERIC BENZYL CARBONATE-DERIVATIVES SI, SLC1A5, BCAT1 MMP2 1252/4885MMP1 2196/4885MMP8 2959/4885

“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.