SCHEMBL3073201

SCHEMBL3073201

O=S(=O)(Cl)c1ccc2c(c1)sc1ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MAPT P10636 4/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GPR3 P46089 1/20 0.50
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
POLB P06746 2/20 0.43
HSD17B10 Q99714 1/20 0.42
MMP12 P39900 4/20 0.41
MMP13 P45452 4/20 0.41
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 1/20 0.38
ALOX15 P16050 1/20 0.37
ACLY P53396 1/20 0.36
CYP1A2 P05177 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL3778171 0.89 MMP12 (0.50) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL3119161 0.88 MAPT (0.41) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL9776217 0.83 KDM4E (0.63) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL8712878 0.82 ALDH1A1 (0.50) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL3085843 0.80 EPM2A (0.40) KDM4EMMP12MMP13
SCHEMBL11505625 0.79 PRKDC (0.33) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL9509001 0.79 ALDH1A1 (0.39) ALDH1A1MAPTRAB9AHPGDGPR3
SCHEMBL26604560 0.78 GPR3 (0.54) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL23693538 0.77 EPM2A (0.38) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL28952710 0.77 KDM4E (0.47) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US disclosed
EP-2144893-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2010-01-20 EP disclosed
EP-2074107-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-07-01 EP disclosed
WO-2008137816-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-11-13 WO disclosed
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 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 (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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS MMP13, MMP2, MMP12 ALDH1A1 456/4885MAPT 3889/4885RAB9A 3446/4885

“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.