SCHEMBL6903324

SCHEMBL6903324

CCC(OC(=O)C(C(=O)O)C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6903322 0.90 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL335362 0.82 MAPT (0.41) MMP1MMP2MMP3MMP9MMP13
SCHEMBL10804781 0.80 MAPT (0.41) MMP1MMP2MMP3MMP9MMP13
SCHEMBL12863865 0.79 ALOX15 (0.31) SMN1; SMN2
SCHEMBL2554204 0.78 TSHR (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL2554203 0.78 TSHR (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL6909412 0.77 MMP1 (0.35) MMP1MMP2MMP3MMP9MMP13
SCHEMBL17515455 0.77
SCHEMBL19018789 0.77 CA2 (0.36)
SCHEMBL20603118 0.76 TSHR (0.42) MMP1MMP2MMP3MMP9MMP13

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
EP-0918802-B2 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY CO BV (NL) 2004-10-06 EP disclosed
EP-0918802-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY CO BV (NL) 2001-11-14 EP disclosed
US-6294497-B1 COMPRISING A TITANIUM COMPOUND, HAVING AT LEAST A TI-HALOGEN BOND AND AN ELECTRON DONER WHICH MAY BE A SUBSTITUTED MALONIC DIESTER, A 1,3-DIETHER OR A SILOXY COMPOUND SUPPORTED ON A MG HALIDE MONTELL TECHNOLOGY COMPANY BV (NL) 2001-09-25 US disclosed
EP-0918802-A2 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-06-02 EP disclosed
WO-1998056830-A2 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-12-17 WO disclosed