SCHEMBL9609231

SCHEMBL9609231

COc1cc2cccc([N+](=O)[O-])c2cc1CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
APEX1 P27695 1/20 0.42
FBP1 P09467 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
PLCG2 P16885 1/20 0.41
FFAR1 O14842 1/20 0.41
CYP1A2 P05177 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL13198053 0.91 ALDH1A1 (0.42) MAPTNPC1RAB9AALDH1A1TDP1
SCHEMBL13206931 0.89 MTNR1A (0.49) MAPTNPC1RAB9AALDH1A1TDP1
SCHEMBL9609207 0.88 HSD17B10 (0.45) MAPTAPEX1NPC1RAB9AALDH1A1
SCHEMBL13198026 0.83 CYP3A4 (0.49) MAPTNPC1RAB9AALDH1A1TDP1
SCHEMBL13206982 0.82 TDP1 (0.44) MAPTNPC1RAB9AALDH1A1TDP1
SCHEMBL9608369 0.81 FBP1 (0.47) MAPTAPEX1FBP1RAB9AALDH1A1
SCHEMBL9609237 0.81 ALDH1A1 (0.46) MAPTALDH1A1TDP1LMNAPOLB
SCHEMBL9609219 0.79 ALDH1A1 (0.45) MAPTNPC1RAB9AALDH1A1TDP1
SCHEMBL426021 0.79 ALDH1A1 (0.56) MAPTALDH1A1TDP1LMNACYP1A2
SCHEMBL27834259 0.78 SLC2A1 (0.56) NPC1RAB9AALDH1A1LMNAMEN1

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