SCHEMBL3614948

SCHEMBL3614948

CCOC(=O)c1oc2ccc(Cl)c(O)c2c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.62
NPC1 O15118 2/20 0.62
MAPT P10636 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.55
KDM4E B2RXH2 5/20 0.53
HSD17B10 Q99714 1/20 0.53
ALDH1A1 P00352 1/20 0.48
HIF1A Q16665 2/20 0.47
NMT2 O60551 4/20 0.46
NMT1 P30419 4/20 0.46
TSHR P16473 1/20 0.45
AHR P35869 1/20 0.45
ADRB2 P07550 2/20 0.45
ADRB1 P08588 2/20 0.45
ADRB3 P13945 2/20 0.45
USP2 O75604 1/20 0.44
ALOX5 P09917 1/20 0.44
BRAF P15056 1/20 0.43
EIF2AK3 Q9NZJ5 1/20 0.43

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
SCHEMBL11058465 0.88 RAB9A (0.68) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL4629109 0.85 RAB9A (0.65) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL10738691 0.85 RAB9A (0.74) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL3608031 0.85 RAB9A (0.65) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL9868567 0.83 RAB9A (0.59) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL3608849 0.83 RAB9A (0.56) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL6871537 0.83 RAB9A (0.62) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL3610943 0.83 RAB9A (0.62) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL10743101 0.83 RAB9A (0.62) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL10738818 0.82 RAB9A (0.60) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2010-06-03 US disclosed
EP-1692124-B1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH CORP (US) 2008-10-15 EP disclosed
US-7420001-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2008-09-02 US disclosed
EP-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 EP disclosed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 WO disclosed
US-20050143422-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-30 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 (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-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC RAB9A 3864/4885NPC1 2605/4885MAPT 4416/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC RAB9A 3864/4885NPC1 2605/4885MAPT 4416/4885

“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.