SCHEMBL1826009

SCHEMBL1826009

CCC(=O)Nc1ccc(OCc2ccc(Cl)cc2Cl)cc1C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
NR4A2 P43354 2/20 0.50
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
KMT2A Q03164 6/20 0.46
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
PPARG P37231 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 2/20 0.45
SLC26A4 O43511 1/20 0.45
MAPT P10636 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL1825956 0.90 NR4A2 (0.57) HTTNR4A2NR4A1NR4A3KMT2A
SCHEMBL1823452 0.79 ADAMTS4 (0.48) NR4A2NR4A1NR4A3KMT2AALDH1A1
SCHEMBL1826502 0.79 MEN1 (0.52) NR4A2NR4A1NR4A3KMT2AALDH1A1
SCHEMBL1825548 0.79 KDM4E (0.54) NR4A2KMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL1826022 0.79 KDM4E (0.54) NR4A2KMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL1827051 0.78 MRGPRX4 (0.60) HTTKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL10397860 0.77 NR4A2 (0.72) HTTNR4A2NR4A1NR4A3KMT2A
SCHEMBL4440066 0.77 KDM4E (0.44) NR4A2NR4A1NR4A3KMT2AALDH1A1
SCHEMBL1822953 0.77 MRGPRX4 (0.49) NR4A2KMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL1827458 0.77 KDM4E (0.51) HTTNR4A2KMT2AALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461205-B2 Anthranilic acid derivatives CHELSEA THERAPEUTICS, INC. (US) 2013-06-11 US disclosed
US-20120283326-A1 ANTHRANILIC ACID DERIVATIVES CHELSEA THERAPEUTICS, INC. 2012-11-08 US disclosed
US-8263658-B2 Anthranilic acid derivatives CHELSEA THERAPEUTICS, INC. (US) 2012-09-11 US disclosed
EP-2118051-B1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF CHELSEA THERAPEUTICS INC (US) 2011-05-04 EP disclosed
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES Chelsea Therapeutics, Inc 2010-02-04 US disclosed
EP-2118051-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF Chelsea Therapeutics, Inc. (US) 2009-11-18 EP disclosed
WO-2008097180-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF CHELSEA THERAPEUTICS, INC. (US) 2008-08-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120283326-A1 ANTHRANILIC ACID DERIVATIVES ACOX3, BCL3, AOC3 HTT 4345/4885NR4A2 1245/4885NR4A1 1436/4885
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES ACOX3, BCL3, AOC3 HTT 4354/4885NR4A2 1234/4885NR4A1 1425/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.