SCHEMBL3534875

SCHEMBL3534875

O=S(=O)(Cl)c1ccc(Oc2ccccc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.53
MMP1 P03956 1/20 0.45
MMP13 P45452 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
DAO P14920 1/20 0.44
SOS1 Q07889 2/20 0.43
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
SCN9A Q15858 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR5 Q9H1C0 1/20 0.41
CXCL8 P10145 1/20 0.40
FAAH O00519 1/20 0.40

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
SCHEMBL1149524 0.83 HSPB1 (0.59) SOS1SCN9A
SCHEMBL6293051 0.81 PARP10 (0.66) PARP10ALDH1A1TDP1DAOFFAR1
SCHEMBL732827 0.81 KMT2A (0.48) ALDH1A1HSD17B10TDP1
SCHEMBL282256 0.80 SOS1 (0.66) MMP1MMP13ALDH1A1HSD17B10TDP1
SCHEMBL1020708 0.79 SMN1; SMN2 (0.49) MMP1MMP13ALDH1A1HSD17B10TDP1
SCHEMBL958076 0.79 HTT (0.66) ALDH1A1HSD17B10TDP1L3MBTL1
SCHEMBL6289863 0.79 PARP10 (0.63) PARP10ALDH1A1DAOFFAR1L3MBTL1
SCHEMBL31244 0.77 SOS1 (0.64) MMP1MMP13ALDH1A1HSD17B10TDP1
SCHEMBL9536733 0.77 SOS1 (0.64) MMP1MMP13ALDH1A1HSD17B10TDP1
SCHEMBL6290343 0.77 PARP10 (0.61) PARP10ALDH1A1DAOL3MBTL1LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858619-B2 Substituted tetrahydroisochinolines as MMP inhibitors, related production method and use as medicine SANOFI-AVENTIS (FR) 2010-12-28 US disclosed
US-20080090821-A1 SUBSTITUTED TETRAHYDROISOCHINOLINES AS MMP INHIBITORS, RELATED PRODUCTION METHOD AND USE AS MEDICINE SANOFI-AVENTIS (FR) 2008-04-17 US disclosed
EP-0977733-B1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PROD INC (US) 2003-09-03 EP disclosed
US-20020006920-A1 Arylsulfonylamino hydroxamic acid derivatives ROBINSON RALPH PELTON (US) 2002-01-17 US disclosed
US-6303636-B1 FOR THERAPY OF ARTHRITIS, CANCER, TISSUE ULCERATION, RESTENOSIS, PERIODONTAL DISEASE, EPIDERMOLYSIS BULLOSA, SCIERITIS, SEPSIS, SEPTIC SHOCK AND OTHER DISEASES INVOLVING THE PRODUCTION OF TUMOR NECROSIS FACTOR PFIZER INC 2001-10-16 US disclosed
EP-0977733-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES Pfizer Products Inc. (US) 2000-02-09 EP disclosed
WO-1998033768-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-08-06 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 (2 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-20080090821-A1 SUBSTITUTED TETRAHYDROISOCHINOLINES AS MMP INHIBITORS, RELATED PRODUCTION METHOD AND USE AS MEDICINE MMP9, MMP3, MMP2 PARP10 393/4885MMP1 9/4885MMP13 8/4885
US-20020006920-A1 Arylsulfonylamino hydroxamic acid derivatives MMP8, MMP1, MMP10 PARP10 257/4885MMP1 2/4885MMP13 18/4885

“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.