SCHEMBL7368355

SCHEMBL7368355

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.49
MMP2 P08253 5/20 0.49
RAB9A P51151 1/20 0.37
ITGB3 P05106 2/20 0.36
ITGA2B P08514 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
KMT2A Q03164 1/20 0.35
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
ADAMTS4 O75173 1/20 0.34

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
Hydrochloric Acid SCHEMBL7368207 0.99 MMP9 (0.48) MMP9MMP2RAB9AITGB3ITGA2B
Hydrochloric Acid SCHEMBL7448629 0.99 MMP9 (0.48) MMP9MMP2RAB9AITGB3ITGA2B
SCHEMBL7368863 0.89 MMP9 (0.49) MMP9MMP2RAB9ACA1CA2
Hydrochloric Acid SCHEMBL7369271 0.86 PLAU (0.35) MMP9MMP2RAB9AITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7372457 0.85 MMP9 (0.45) MMP9MMP2RAB9AITGB3ITGA2B
Hydrochloric Acid SCHEMBL6433893 0.84 PKLR (0.36) MMP2RAB9AITGB3ITGA2BCYP2C9
Hydrochloric Acid SCHEMBL7376136 0.82 PLAU (0.48) MMP9MMP2ITGB3MMP13ADAMTS4
Trifluoroacetic Acid SCHEMBL7368831 0.81 F2 (0.46) MMP9MMP2ITGB3ITGA2BALDH1A1
Hydrochloric Acid SCHEMBL7588548 0.80 PLG (0.50) MMP9MMP2MMP13ADAMTS4MMP7
SCHEMBL6437440 0.78 PLAU (0.40) KDM4EMEN1ALDH1A1KMT2APOLB

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