SCHEMBL1827007

SCHEMBL1827007

O=C(O)c1cc(COc2ccc(C(F)(F)F)c(Cl)c2)ccc1NC(=O)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.53
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 1/20 0.44
KDR P35968 7/20 0.42
S1PR1 P21453 3/20 0.42
F10 P00742 1/20 0.42
PIM1 P11309 1/20 0.41
PDGFRA P16234 1/20 0.41
S1PR5 Q9H228 1/20 0.41
BRAF P15056 5/20 0.41
ITGA4 P13612 1/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 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
SCHEMBL1826416 0.96 MRGPRX4 (0.50) MRGPRX4KDM4EHSD17B10KDRS1PR1
SCHEMBL1827176 0.92 S1PR1 (0.48) MRGPRX4KDM4EHSD17B10KDRS1PR1
SCHEMBL1825725 0.92 KDM4E (0.47) MRGPRX4KDM4EHSD17B10KDRF10
SCHEMBL1825932 0.90 S1PR1 (0.50) KDM4EHSD17B10KDRS1PR1BRAF
SCHEMBL1827185 0.90 KDM4E (0.50) MRGPRX4KDM4EHSD17B10KDRS1PR1
SCHEMBL1826718 0.89 KDM4E (0.45) MRGPRX4KDM4EHSD17B10KDRS1PR1
SCHEMBL1825497 0.88 KDM4E (0.47) MRGPRX4KDM4EHSD17B10S1PR1F10
SCHEMBL1825365 0.88 MRGPRX4 (0.51) MRGPRX4KDM4EHSD17B10S1PR1F10
SCHEMBL1825026 0.87 KDR (0.47) MRGPRX4KDM4EHSD17B10KDRF10
SCHEMBL1824147 0.87 KDM4E (0.47) MRGPRX4KDM4EHSD17B10KDRF10

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
EP-2118051-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF Chelsea Therapeutics, Inc. (US) 2009-11-18 EP claimed
WO-2008097180-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF CHELSEA THERAPEUTICS, INC. (US) 2008-08-14 WO 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

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 MRGPRX4 1127/4885KDM4E 4207/4885HSD17B10 1370/4885
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES ACOX3, BCL3, AOC3 MRGPRX4 1135/4885KDM4E 4172/4885HSD17B10 1349/4885

“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.