SCHEMBL7280924

SCHEMBL7280924

CN(C)CCOc1ccc(Cl)c(C(=O)O)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 16/20 0.51
ALDH1A1 P00352 11/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
GAA P10253 2/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 3/20 0.47
LMNA P02545 1/20 0.47
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45

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
SCHEMBL7280699 0.81 KDM4E (0.48) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7313229 0.76 KDM4E (0.44) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7313232 0.75 ADRB2 (0.55) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL7295207 0.74 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8564952 0.74 ALDH1A1 (0.61) KDM4EALDH1A1MAPK1TDP1LMNA
SCHEMBL7532980 0.73 KDM4E (0.54) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11766359 0.73 GAA (0.56) KDM4EALDH1A1GAAMAPK1
SCHEMBL7288458 0.73 CLCN2 (0.60) SMN1; SMN2MEN1KMT2A
SCHEMBL7421848 0.72 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL9082014 0.72 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5597841-A 2-saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP, INC. (US) 1997-01-28 US disclosed
EP-0594257-B1 2-Saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC (US) 1996-07-10 EP disclosed
US-5512589-A TREATING DEGENERATIVE DISEASES STERLING WINTHROP INC. (US) 1996-04-30 US disclosed
EP-0594257-A1 2-Saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC. (US) 1994-04-27 EP disclosed
US-5306818-A Treating degenerative diseases such as emphysema, rheumatoid arthritis and pancreatitis STERLING WINTHROP INC. (US) 1994-04-26 US disclosed
US-5250696-A Treatment of degenerative diseases STERLING WINTHROP INC. (US) 1993-10-05 US disclosed
US-5128339-A Emphysema, rheumatoid arthritis, pancreatitis STERLING WINTHROP INC. (US) 1992-07-07 US disclosed
EP-0483928-A1 2-Saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use STERLING WINTHROP INC. (US) 1992-05-06 EP disclosed