SCHEMBL7368863

SCHEMBL7368863

N=C(N)N(Cl)c1cncc2cc(S(=O)(=O)N[C@@H](CCC(N)=O)C(=O)O)ccc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 11/20 0.49
MMP2 P08253 10/20 0.49
L3MBTL1 Q9Y468 1/20 0.42
MMP8 P22894 3/20 0.39
MMP13 P45452 1/20 0.39
ADAMTS4 O75173 1/20 0.39
RAB9A P51151 1/20 0.38
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MMP12 P39900 2/20 0.36
MMP14 P50281 2/20 0.36
KDM4E B2RXH2 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
Trifluoroacetic Acid SCHEMBL7372457 0.95 MMP9 (0.45) MMP9MMP2L3MBTL1MMP8MMP13
SCHEMBL7368355 0.89 MMP9 (0.49) MMP9MMP2L3MBTL1MMP8MMP13
Hydrochloric Acid SCHEMBL7448629 0.89 MMP9 (0.48) MMP9MMP2L3MBTL1MMP8MMP13
Hydrochloric Acid SCHEMBL7368207 0.89 MMP9 (0.48) MMP9MMP2L3MBTL1MMP8MMP13
Hydrochloric Acid SCHEMBL7369271 0.88 PLAU (0.35) MMP9MMP2MMP8MMP13ADAMTS4
Hydrochloric Acid SCHEMBL6433893 0.86 PKLR (0.36) MMP2MMP13RAB9AKDM4E
Hydrochloric Acid SCHEMBL7376136 0.83 PLAU (0.48) MMP9MMP2L3MBTL1MMP13ADAMTS4
Trifluoroacetic Acid SCHEMBL7368831 0.83 F2 (0.46) MMP9MMP2L3MBTL1MMP13ADAMTS4
Hydrochloric Acid SCHEMBL7588548 0.81 PLG (0.50) MMP9MMP2MMP13ADAMTS4MMP12
SCHEMBL7368871 0.80 MMP9 (0.49) MMP9MMP2L3MBTL1MMP8MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed