SCHEMBL9609219

SCHEMBL9609219

COC(=O)C(Cc1cc2c([N+](=O)[O-])cccc2cc1OC)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.45
TDP1 Q9NUW8 1/20 0.40
G6PD P11413 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL9609207 0.81 HSD17B10 (0.45) ALDH1A1TDP1MAPTKDM4EL3MBTL1
SCHEMBL13198026 0.81 CYP3A4 (0.49) ALDH1A1TDP1MAPTKDM4EGAA
SCHEMBL9608372 0.81 ALDH1A1 (0.39) ALDH1A1TDP1MAPK1L3MBTL1HTT
SCHEMBL13206982 0.80 TDP1 (0.44) ALDH1A1TDP1MAPTKDM4EGAA
SCHEMBL9609209 0.80 ALDH1A1 (0.58) ALDH1A1TDP1G6PDCRHBPCRHR2
SCHEMBL9609237 0.79 ALDH1A1 (0.46) ALDH1A1TDP1MAPTKDM4EGAA
SCHEMBL9609231 0.79 MAPT (0.43) ALDH1A1TDP1MAPTKDM4ELMNA
SCHEMBL13198053 0.79 ALDH1A1 (0.42) ALDH1A1TDP1G6PDCRHBPCRHR2
SCHEMBL13206931 0.78 MTNR1A (0.49) ALDH1A1TDP1MAPTKDM4EGAA
SCHEMBL426021 0.77 ALDH1A1 (0.56) ALDH1A1TDP1MAPTKDM4EGAA

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