SCHEMBL9608370

SCHEMBL9608370

CC1(C)C(=O)Cc2ccc3c(O)cccc3c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.39
CYP1A2 P05177 4/20 0.38
HSD17B10 Q99714 3/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP3A4 P08684 2/20 0.38
KDM4E B2RXH2 2/20 0.38
PARP1 P09874 2/20 0.38
CYP2C9 P11712 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
BLM P54132 1/20 0.38
PARP15 Q460N3 1/20 0.38
MAPT P10636 2/20 0.36
THRB P10828 2/20 0.36
ALOX15 P16050 2/20 0.36
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL9608366 0.70 PNMT (0.44) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4
SCHEMBL18403201 0.69 CYP1A2 (0.42) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4
SCHEMBL9608368 0.68 PNMT (0.49) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4
SCHEMBL9608363 0.67 PNMT (0.60) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4
SCHEMBL27532014 0.66 BCL2L1 (0.60) PNMTCYP1A2HSD17B10ALDH1A1HPGD
SCHEMBL16107538 0.65 IDO1 (0.65) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4
SCHEMBL4869305 0.65 IDO1 (0.73) CYP1A2HSD17B10ALDH1A1CYP3A4KDM4E
SCHEMBL28327 0.65 IDO1 (0.73) CYP1A2HSD17B10ALDH1A1CYP3A4KDM4E
SCHEMBL29351230 0.65 IDO1 (0.73) CYP1A2HSD17B10ALDH1A1CYP3A4KDM4E
SCHEMBL10298962 0.64 HPGD (0.52) PNMTCYP1A2HSD17B10ALDH1A1CYP3A4

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 9 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