SCHEMBL9609210

SCHEMBL9609210

COc1cc2cccc([N+](=O)[O-])c2cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
BRCA1 P38398 1/20 0.46
HNF4A P41235 1/20 0.46
HIF1A Q16665 1/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 1/20 0.46
MCL1 Q07820 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL28577614 0.94 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL426021 0.88 ALDH1A1 (0.56) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL15803233 0.84 ALDH1A1 (0.51) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL419966 0.82 ALDH1A1 (0.58) ALDH1A1TDP1SMN1; SMN2TP53MEN1
SCHEMBL9609237 0.79 ALDH1A1 (0.46) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL9609207 0.79 HSD17B10 (0.45) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL13198026 0.79 CYP3A4 (0.49) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL13206982 0.78 TDP1 (0.44) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL9609209 0.78 ALDH1A1 (0.58) ALDH1A1TDP1SMN1; SMN2TP53CYP1A2
SCHEMBL14859939 0.77 ALDH1A1 (0.51) ALDH1A1TDP1SMN1; SMN2MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9551029-B2 Methods and kits using extended rhodamine dyes APPLIED BIOSYSTEMS, LLC (US) 2017-01-24 US disclosed
US-20160122813-A1 Methods And Kits Using Extended Rhodamine Dyes THE PERKIN-ELMER CORPORATION 2016-05-05 US disclosed
US-9309561-B2 Methods and kits using extended rhodamine dyes APPLIED BIOSYSTEMS, LLC (US) 2016-04-12 US disclosed
US-20140171336-A1 Methods and Kits Using Extended Rhodamine Dyes Life Technologies Corporation (US) 2014-06-19 US disclosed
US-8628975-B2 Methods and kits using extended rhodamine dyes APPLIED BIOSYSTEMS, LLC (US) 2014-01-14 US disclosed
US-20120135885-A1 Methods and Kits Using Extended Rhodamine Dyes Life Technologies Corporation (US) 2012-05-31 US disclosed
US-8124746-B2 Methods and kits using extended rhodamine dyes APPLIED BIOSYSTEMS, LLC (US) 2012-02-28 US disclosed
US-20110053282-A1 Methods and Kits Using Extended Rhodamine Dyes Life Technologies Corporation (US) 2011-03-03 US disclosed
US-7776568-B2 Rhodamine dye compounds for patterns with DNA sequences for kits APPLIED BIOSYSTEMS, LLC (US) 2010-08-17 US disclosed
US-7776568-B2 Rhodamine dye compounds for patterns with DNA sequences for kits APPLIED BIOSYSTEMS, LLC (US) 2010-08-17 US disclosed