SCHEMBL8733835

SCHEMBL8733835

O=[N+](O)c1ccc(C[n+]2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ACHE P22303 2/20 0.46
BCHE P06276 1/20 0.46
LMNA P02545 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CHKA P35790 4/20 0.39
NPSR1 Q6W5P4 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL8733830 0.81 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL11134565 0.80 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
Bromide SCHEMBL7965212 0.80 MEN1 (0.69) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL10325407 0.79 ACHE (0.64) ALDH1A1SMN1; SMN2KDM4EACHEBCHE
Hydrochloric Acid SCHEMBL11637202 0.77 ACHE (0.61) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
Bromide SCHEMBL2831425 0.77 ACHE (0.68) ALDH1A1SMN1; SMN2ACHEBCHELMNA
SCHEMBL6270309 0.74 PABPC1 (0.61) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9505752 0.73 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL93665 0.73 CHKA (0.59) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL29266014 0.72 ALDH1A1 (0.53) ALDH1A1KDM4EACHEBCHEL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0385504-B1 Heat-latent curing catalyst and resin compositions containing the same NIPPON PAINT CO LTD (JP) 1995-10-04 EP claimed
EP-0543022-B1 PROCESS FOR PRODUCING STYRENIC POLYMER AND CATALYST THEREFOR IDEMITSU KOSAN CO (JP) 1998-02-04 EP disclosed
US-5391661-A Process for producing a styrenic polymer and a catalyst for use therein IDEMITSU KOSAN CO., LTD. (JP) 1995-02-21 US disclosed
EP-0543022-A1 PROCESS FOR PRODUCING STYRENIC POLYMER AND CATALYST THEREFOR IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-05-26 EP disclosed