SCHEMBL9877541

SCHEMBL9877541

CCCCCCCCCCCCCCCCCCNC(=O)c1c(C)ccc(-n2oc(C(C)(C)C)c(CCl)c2=O)c1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MGLL Q99685 1/20 0.34
CNR1 P21554 3/20 0.33
CNR2 P34972 3/20 0.33
POLB P06746 1/20 0.33
CYP19A1 P11511 1/20 0.33
NAAA Q02083 1/20 0.32
PTGS2 P35354 1/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 2/20 0.32
EPHX2 P34913 1/20 0.32
MLYCD O95822 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL9876532 0.82 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL9876597 0.82 MAPT (0.34) ALDH1A1LMNASMN1; SMN2MAPTMEN1
SCHEMBL9769708 0.77 LMNA (0.52) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL9877535 0.76 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL9864397 0.69 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2MAPTGAA
Hydrochloric Acid SCHEMBL9864700 0.69 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL9769700 0.68 LMNA (0.56) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL10598597 0.64 L3MBTL1 (0.46) ALDH1A1LMNASMN1; SMN2MAPTMEN1
SCHEMBL9771372 0.63 MAPT (0.34) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL12902000 0.63 NAAA (0.47) L3MBTL1MGLLNAAAUSP2

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