SCHEMBL7165238

SCHEMBL7165238

[NH]C(=O)c1ccccc1N1C(=O)C=CC1=O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 3/20 0.64
ALDH1A1 P00352 3/20 0.64
HSP90AA1 P07900 2/20 0.64
ATM Q13315 2/20 0.64
NPSR1 Q6W5P4 2/20 0.64
PKM P14618 1/20 0.64
CCR6 P51684 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
MGLL Q99685 13/20 0.50
MITF O75030 1/20 0.46
HTT P42858 1/20 0.46
FAAH O00519 4/20 0.46
ALOX15 P16050 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
APEX1 P27695 1/20 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
SCHEMBL183052 0.82 ALDH1A1 (0.71) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL29364136 0.82 ALDH1A1 (0.71) TLR9ALDH1A1HSP90AA1ATMNPSR1
Hydrochloric Acid SCHEMBL6753288 0.81 ALDH1A1 (0.69) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL9240798 0.81 TLR9 (0.64) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL29510541 0.81 TLR9 (0.64) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL11324489 0.81 TLR9 (0.64) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL10938557 0.81 ALDH1A1 (0.64) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL3036292 0.81 ALDH1A1 (0.64) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL1673297 0.78 TLR9 (1.00) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL28752508 0.77 TLR9 (0.63) TLR9ALDH1A1HSP90AA1ATMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562632-B1 Reactive dye for use as diagnostic tool in the analysis of biological systems MOLECULAR PROBES, INC. 2003-05-13 US claimed
US-6004536-A USED FOR STAINING MEMBRANES IN CELLS OR ISOLATED FROM CELLS, ARE WELL-RETAINED THEREIN MOLECULAR PROBES, INC. (US) 1999-12-21 US claimed
US-5798276-A DETECTING COMPLEMENTARY MEMBER OF SPECIFIC BINDING PAIR USING FLUORESCENT CONJUGATE MOLECULAR PROBES, INC. (US) 1998-08-25 US claimed