SCHEMBL6283955

SCHEMBL6283955

CCCCCCc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(CCN3CCOCC3)[C@@H](C(=O)NO)C(C)C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.57
MMP13 P45452 1/20 0.57
LMNA P02545 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
RAB9A P51151 3/20 0.51
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
ALDH1A1 P00352 3/20 0.46
CA1 P00915 1/20 0.45
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
MAPK1 P28482 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL6423316 0.97 MMP2 (0.59) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6423313 0.97 MMP2 (0.59) MMP2MMP13LMNASMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL6425721 0.96 MMP2 (0.58) MMP2MMP13LMNASMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL6425723 0.96 MMP2 (0.58) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6438768 0.94 MMP2 (0.60) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6438773 0.94 MMP2 (0.60) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6422847 0.88 MMP2 (0.64) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6450980 0.87 MMP2 (0.70) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6450974 0.87 MMP2 (0.70) MMP2MMP13LMNASMN1; SMN2RAB9A
SCHEMBL6421338 0.86 SMN1; SMN2 (0.49) MMP2MMP13LMNASMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869951-B1 Method of changing conformation of a matrix metalloproteinase PHARMACIA CORPORATION (US) 2005-03-22 US disclosed
EP-0983267-B1 AMIDOAROMATIC RING SULFONAMIDE HYDROXAMIC ACID COMPOUNDS PHARMACIA CORP (US) 2005-01-26 EP disclosed
US-6451791-B1 Amidoaromatic ring sulfonamide hydroxamic acid compounds MONSANTO COMPANY 2002-09-17 US disclosed