SCHEMBL3608849

SCHEMBL3608849

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPC1 O15118 2/20 0.56
MAPT P10636 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.52
KDM4E B2RXH2 5/20 0.51
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 1/20 0.47
HIF1A Q16665 2/20 0.45
NMT2 O60551 4/20 0.44
NMT1 P30419 4/20 0.44
TSHR P16473 1/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP13 P45452 1/20 0.43
MMP14 P50281 1/20 0.43
ADRB2 P07550 2/20 0.43
ADRB1 P08588 2/20 0.43
ADRB3 P13945 2/20 0.43
AHR P35869 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 0.86 RAB9A (0.68) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3618501 0.86 RAB9A (0.53) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3622124 0.85 RAB9A (0.57) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3617991 0.84 RAB9A (0.56) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3614948 0.83 RAB9A (0.62) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3613925 0.83 EDNRA (0.56) RAB9ASMN1; SMN2NPC1L3MBTL1KDM4E
SCHEMBL3609779 0.80 L3MBTL1 (0.48) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL2909528 0.78 L3MBTL1 (0.59) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL3607399 0.75 KDM4E (0.76) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1
SCHEMBL10460783 0.75 L3MBTL1 (0.61) RAB9ASMN1; SMN2NPC1MAPTL3MBTL1

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 3864/4885SMN1; SMN2 3220/4885NPC1 2605/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC RAB9A 3864/4885SMN1; SMN2 3220/4885NPC1 2605/4885

“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.