SCHEMBL9535499

SCHEMBL9535499

CCN(CC)CCNC(=O)c1ccc([N+](=O)[O-])c(Sc2ccc(F)cc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
PRMT5 O14744 1/20 0.49
WDR77 Q9BQA1 1/20 0.49
POLB P06746 1/20 0.48
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
SLC22A2 O15244 1/20 0.43
SLC22A1 O15245 1/20 0.43
TSHR P16473 1/20 0.43
ACHE P22303 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
USP10 Q14694 1/20 0.43
USP7 Q93009 1/20 0.43
USP47 Q96K76 1/20 0.43

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
SCHEMBL9536466 0.87 USP7 (0.48) L3MBTL1POLBMAPTSMN1; SMN2KMT2A
SCHEMBL9537385 0.84 L3MBTL1 (0.55) L3MBTL1POLBSMN1; SMN2KMT2ALMNA
Diethylamine SCHEMBL9535505 0.84 USP7 (0.46) L3MBTL1POLBMAPTSMN1; SMN2KMT2A
SCHEMBL18376382 0.82 MAPT (0.66) L3MBTL1PRMT5WDR77POLBMAPT
Hydrochloric Acid SCHEMBL18763571 0.82 MAPT (0.65) L3MBTL1PRMT5WDR77POLBMAPT
SCHEMBL9537206 0.81 USP7 (0.51) L3MBTL1POLBMAPTSMN1; SMN2KMT2A
SCHEMBL9535494 0.81 USP7 (0.43) POLBMAPTSMN1; SMN2KMT2AALDH1A1
Hydrochloric Acid SCHEMBL9539508 0.80 L3MBTL1 (0.53) L3MBTL1POLBMAPTSMN1; SMN2KMT2A
SCHEMBL9534137 0.79 LMNA (0.50) L3MBTL1POLBMAPTSMN1; SMN2KMT2A
SCHEMBL9534810 0.79 USP7 (0.51) L3MBTL1POLBMAPTSMN1; SMN2KMT2A

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
EP-0292979-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-21 EP disclosed
US-5034417-A Antiinflammatory agents or analgesics FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0292979-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-30 EP disclosed