SCHEMBL7274698

SCHEMBL7274698

C=CCn1cccc([N+](=O)[O-])c1=O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.51
ALDH1A1 P00352 4/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 8/20 0.45
RAB9A P51151 7/20 0.45
RAD52 P43351 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.42
ELANE P08246 1/20 0.42
GFER P55789 1/20 0.41
POLB P06746 2/20 0.40
GAA P10253 1/20 0.39
APOBEC3A P31941 1/20 0.38
MCL1 Q07820 1/20 0.38
APOBEC3G Q9HC16 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
SCHEMBL15435555 0.85 RECQL (0.52) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL25434321 0.78 RECQL (0.55) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL17603200 0.78 RECQL (0.55) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL7234130 0.77 RAD52 (0.56) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL15804012 0.77 RECQL (0.51) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL26181571 0.76 RECQL (0.42) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL16794652 0.75 RECQL (0.52) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL20945118 0.75 RECQL (0.52) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL13075102 0.74 ALDH1A1 (0.51) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL15804039 0.74 RECQL (0.51) RECQLALDH1A1HTTSMN1; SMN2L3MBTL1

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-0509769-B1 Heterocyclic amides having HLE inhibiting activity ZENECA LTD (GB) 1996-09-11 EP disclosed
US-5521179-A Heterocyclic amides ZENECA LIMITED (GB) 1996-05-28 US disclosed
EP-0509769-A2 Heterocyclic amides having HLE inhibiting activity ZENECA LIMITED (GB) 1992-10-21 EP disclosed