SCHEMBL6608012

SCHEMBL6608012

COc1ccc(CNC(=O)Oc2ccc3c(c2)S(=O)(=O)N(Cc2ccc(N)cc2)C(=O)N3C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
PPIB P23284 1/20 0.40
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TPSAB1 Q15661 2/20 0.38
TPSD1 Q9BZJ3 2/20 0.38
TPSG1 Q9NRR2 2/20 0.38
METAP2 P50579 1/20 0.37
KLKB1 P03952 1/20 0.36
ALDH1A1 P00352 1/20 0.36
FAAH O00519 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
SCHEMBL6605355 0.88 LMNA (0.51) LMNATHRBMAPTALDH1A1
SCHEMBL6604906 0.85 L3MBTL1 (0.50) LMNATHRBL3MBTL1TP53ALDH1A1
SCHEMBL6605709 0.84 GAA (0.44) LMNATHRBFAAH
SCHEMBL6606492 0.79 LMNA (0.52) LMNATHRBMAPT
SCHEMBL6609494 0.78 LMNA (0.51) LMNATHRBMAPT
SCHEMBL6512442 0.76 LMNA (0.49) LMNATHRBMAPTALDH1A1
SCHEMBL6607095 0.76 LMNA (0.49) LMNATHRBL3MBTL1MAPT
SCHEMBL16277925 0.75 CMA1 (0.43) LMNAMAPTTP53
SCHEMBL6470981 0.75 LMNA (0.47) LMNATHRBMAPTTP53
SCHEMBL6607569 0.73 LMNA (0.48) LMNATHRBMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368327-B1 BENZO THIADIAZINE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2004-10-20 EP claimed