SCHEMBL3936083

SCHEMBL3936083

O=C(O)c1ccc2sccc2c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.47
SELL P14151 1/20 0.45
SELP P16109 1/20 0.45
XDH P47989 1/20 0.43
SLC22A12 Q96S37 1/20 0.43
GPR35 Q9HC97 2/20 0.41
ALDH1A1 P00352 4/20 0.39
TSHR P16473 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
HPGD P15428 4/20 0.39
HSD17B10 Q99714 3/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX12 P18054 1/20 0.39
ATIC P31939 1/20 0.39

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
SCHEMBL6337381 0.83 ALDH1A1 (0.46) XDHSLC22A12GPR35ALDH1A1TSHR
SCHEMBL3808419 0.79 TSHR (0.41) XDHSLC22A12GPR35ALDH1A1TSHR
SCHEMBL3815752 0.79 MRGPRX4 (0.43) XDHSLC22A12GPR35ALDH1A1TSHR
SCHEMBL6283230 0.79 CA12 (0.46) ALDH1A1TSHRCA12CA1CA2
SCHEMBL2083799 0.74 NR4A1 (0.48) GPR35ALDH1A1TSHRCA12CA1
SCHEMBL1173895 0.74 LDHA (0.61) LDHASELLSELPALDH1A1TSHR
SCHEMBL29750616 0.74 LDHA (0.61) LDHASELLSELPALDH1A1TSHR
SCHEMBL6151681 0.73 CA12 (0.43) SELLSELPXDHSLC22A12GPR35
SCHEMBL7069502 0.72 CXCR2 (0.48) XDHSLC22A12ALDH1A1TSHRHPGD
SCHEMBL29860525 0.71 SELL (0.79) LDHASELLSELPALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230147360-A1 ARYLAMIDES AND METHODS OF USE THEREOF GENZYME CORPORATION 2023-05-11 US disclosed
EP-2041073-B1 CXCR2 INHIBITORS SANOFI SA (FR) 2016-07-27 EP disclosed
US-8980938-B2 CXCR2 inhibitors SANOFI (FR) 2015-03-17 US disclosed
US-8642643-B2 CXCR2 antagonists SANOFI (FR) 2014-02-04 US disclosed
EP-2041072-B1 CXCR2 ANTAGONISTS SANOFI SA (FR) 2013-09-11 EP disclosed
US-20090258936-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-10-15 US disclosed
US-20090258906-A1 CXCR2 ANTAGONISTS SANOFI-AVENTIS (FR) 2009-10-15 US disclosed
EP-2041073-A1 CXCR2 INHIBITORS Sanofi-Aventis (FR) 2009-04-01 EP disclosed
EP-2041072-A1 CXCR2 ANTAGONISTS Sanofi-Aventis (FR) 2009-04-01 EP disclosed
WO-2008000410-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2008-01-03 WO disclosed
WO-2008000408-A1 CXCR2 ANTAGONISTS SANOFI-AVENTIS (FR) 2008-01-03 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 (3 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-20090258936-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR3 LDHA 2945/4885SELL 82/4885SELP 340/4885
US-20230147360-A1 ARYLAMIDES AND METHODS OF USE THEREOF CFTR, AADAC, ARSA LDHA 3966/4885SELL 4638/4885SELP 4518/4885
US-20090258906-A1 CXCR2 ANTAGONISTS CXCR2, CXCR1, CXCR3 LDHA 3088/4885SELL 86/4885SELP 336/4885

“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.