SCHEMBL14596452

SCHEMBL14596452

Cc1ccc([N+](=O)[O-])nn1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
HSD17B10 Q99714 2/20 0.38
ACHE P22303 1/20 0.38
MAPT P10636 4/20 0.38
TDP1 Q9NUW8 3/20 0.37
CTSB P07858 1/20 0.36
CTSH P09668 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 2/20 0.34
APLNR P35414 1/20 0.34
CYP3A4 P08684 1/20 0.34
HTT P42858 1/20 0.34
F2 P00734 1/20 0.34
PLAU P00749 1/20 0.34
KLKB1 P03952 1/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL3293293 0.85 MAPT (0.39) ALDH1A1HSD17B10ACHEMAPTTDP1
SCHEMBL17654089 0.73 MAPT (0.42) ALDH1A1HSD17B10MAPTTDP1RAB9A
SCHEMBL310954 0.71
SCHEMBL29549138 0.71
SCHEMBL9869630 0.68 MAPT (0.36) ALDH1A1HSD17B10ACHEMAPTCTSB
SCHEMBL30945318 0.67 ALDH1A1 (0.49) ALDH1A1ACHEMAPTTDP1RAB9A
SCHEMBL2509869 0.67 ALDH1A1 (0.49) ALDH1A1ACHEMAPTTDP1RAB9A
SCHEMBL28029436 0.67 ALDH1A1 (0.44) ALDH1A1HSD17B10ACHEMAPTTDP1
SCHEMBL7988299 0.67 MAPT (0.47) ALDH1A1HSD17B10ACHEMAPTRAB9A
Ammonia Solution, Strong SCHEMBL27768089 0.65 ALDH1A1 (0.43) ALDH1A1HSD17B10ACHEMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070020479-A1 Luminescent-polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-01-25 US disclosed
US-20070020479-A1 Luminescent-polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-01-25 US disclosed