SCHEMBL1824677

SCHEMBL1824677

O=C(O)c1cc(OCc2ccc(Br)cc2Cl)ccc1NC(=O)C1CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
HSD17B10 Q99714 1/20 0.52
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
ABL1 P00519 1/20 0.43
AKR1C2 P52895 2/20 0.42
AKR1C1 Q04828 2/20 0.42
NR4A2 P43354 4/20 0.42
FFAR1 O14842 1/20 0.40
NR4A1 P22736 1/20 0.40
NR4A3 Q92570 1/20 0.40
S1PR1 P21453 1/20 0.40
LTK P29376 1/20 0.40
TAOK1 Q7L7X3 1/20 0.40
S1PR5 Q9H228 1/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HPGD P15428 2/20 0.39

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
SCHEMBL1825095 0.89 KDM4E (0.54) KDM4EHSD17B10KMT2AMEN1ABL1
SCHEMBL1825586 0.89 NR4A2 (0.55) KDM4EHSD17B10KMT2AMEN1NR4A2
SCHEMBL4437310 0.88 KDM4E (0.48) KDM4EHSD17B10KMT2AMEN1ABL1
SCHEMBL1823309 0.88 KDM4E (0.52) KDM4EHSD17B10KMT2AMEN1ABL1
SCHEMBL1822929 0.88 KDM4E (0.52) KDM4EHSD17B10KMT2AMEN1ABL1
SCHEMBL1823212 0.85 KDM4E (0.52) KDM4EHSD17B10KMT2AABL1NR4A2
SCHEMBL1826502 0.85 MEN1 (0.52) KDM4EKMT2AMEN1AKR1C2AKR1C1
SCHEMBL1825088 0.85 KDM4E (0.49) KDM4EHSD17B10KMT2AMEN1ABL1
SCHEMBL1826609 0.85 KDM4E (0.49) KDM4EHSD17B10KMT2AMEN1S1PR1
SCHEMBL4446018 0.82 KDR (0.42) KDM4EHSD17B10KMT2AMEN1NR4A2

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 12 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 claimed
US-20120283326-A1 ANTHRANILIC ACID DERIVATIVES CHELSEA THERAPEUTICS, INC. 2012-11-08 US claimed
US-8263658-B2 Anthranilic acid derivatives CHELSEA THERAPEUTICS, INC. (US) 2012-09-11 US claimed
EP-2118051-B1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF CHELSEA THERAPEUTICS INC (US) 2011-05-04 EP claimed
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES Chelsea Therapeutics, Inc 2010-02-04 US claimed
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 KDM4E 4207/4885HSD17B10 1370/4885KMT2A 3537/4885
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES ACOX3, BCL3, AOC3 KDM4E 4172/4885HSD17B10 1349/4885KMT2A 3535/4885

“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.