SCHEMBL9864397

SCHEMBL9864397

CCCCCCCCCCCCCCCCNC(=O)c1ccc(-n2oc(C(C)(C)C)c(COc3ccc(N)cc3)c2=O)c([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
LMNA P02545 6/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 2/20 0.44
POLB P06746 1/20 0.42
PLA2G4B P0C869 1/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ACAT1 P24752 1/20 0.36
NPY5R Q15761 1/20 0.36
HDAC1 Q13547 2/20 0.36

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
Hydrochloric Acid SCHEMBL9864700 0.99 ALDH1A1 (0.48) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL6932969 0.85 ALDH1A1 (0.55) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9876594 0.83 MAPT (0.41) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9769708 0.81 LMNA (0.52) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9877535 0.79 ALDH1A1 (0.48) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9876597 0.74 MAPT (0.34) ALDH1A1LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL9769700 0.73 LMNA (0.56) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9823387 0.71 ALDH1A1 (0.49) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9769698 0.70 LMNA (0.50) ALDH1A1LMNAMAPTSMN1; SMN2GAA
SCHEMBL9877541 0.69 ALDH1A1 (0.38) ALDH1A1LMNAMAPTSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5049477-A Image forming, etching, plating FUJI PHOTO FILM CO., LTD. (JP) 1991-09-17 US disclosed