SCHEMBL8897652

SCHEMBL8897652

CC(C)(C)CCCC(NS(=O)(=O)c1ccc(F)cc1)c1ccc(CCCC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
EEF2K O00418 3/20 0.45
ALDH1A1 P00352 3/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
TBXAS1 P24557 1/20 0.40
MMP8 P22894 1/20 0.40
MMP12 P39900 1/20 0.40
MMP14 P50281 1/20 0.40
GFER P55789 1/20 0.40
TBXA2R P21731 2/20 0.39
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38

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
SCHEMBL8896390 0.98 NPSR1 (0.46) NPSR1LMNAEEF2KALDH1A1ATM
SCHEMBL8897070 0.96 NPSR1 (0.47) NPSR1LMNAEEF2KALDH1A1ATM
SCHEMBL8898592 0.91 ALDH1A1 (0.48) NPSR1EEF2KALDH1A1ATML3MBTL1
SCHEMBL8896082 0.90 SIGMAR1 (0.41) NPSR1EEF2KALDH1A1ATML3MBTL1
SCHEMBL8895816 0.90 NPSR1 (0.47) NPSR1EEF2KALDH1A1ATML3MBTL1
SCHEMBL8895661 0.90 NPSR1 (0.47) NPSR1EEF2KALDH1A1ATML3MBTL1
SCHEMBL8895062 0.90 FFAR1 (0.50) NPSR1LMNAEEF2KALDH1A1ATM
SCHEMBL8418164 0.89 LMNA (0.45) NPSR1LMNAEEF2KALDH1A1ATM
SCHEMBL8417294 0.89 LMNA (0.45) NPSR1LMNAEEF2KALDH1A1ATM
SCHEMBL8418033 0.89 LMNA (0.45) NPSR1LMNAEEF2KALDH1A1ATM

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
US-5597848-A PLATELET AGGREGATION INHIBITORS, ANTITHROMBOTIC AGENTS, ANTIASTHMATIC AGENTS, ANTIALLERGIC AGENTS HOKURIKU SEIYAKU CO., LTD. (JP) 1997-01-28 US disclosed
EP-0663392-A1 BENZENESULFONAMIDE DERIVATIVE AND USE THEREOF HOKURIKU SEIYAKU CO., LTD. (JP) 1995-07-19 EP disclosed