SCHEMBL1827185

SCHEMBL1827185

O=C(O)c1cc(OCc2ccc(C(F)(F)F)c(C(F)(F)F)c2)ccc1NC(=O)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
HSD17B10 Q99714 1/20 0.50
F10 P00742 6/20 0.44
MRGPRX4 Q96LA9 2/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
HPGD P15428 1/20 0.41
BRAF P15056 1/20 0.41
KDR P35968 1/20 0.41
DHODH Q02127 1/20 0.41
S1PR1 P21453 2/20 0.41
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
POLB P06746 1/20 0.40
RIPK1 Q13546 1/20 0.40
RIPK3 Q9Y572 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
SCHEMBL1825725 0.96 KDM4E (0.47) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1825233 0.93 KDR (0.49) KDM4EHSD17B10F10MEN1KMT2A
SCHEMBL1824147 0.93 KDM4E (0.47) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1828191 0.92 KDM4E (0.47) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1822714 0.92 KDM4E (0.49) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1826416 0.92 MRGPRX4 (0.50) KDM4EHSD17B10F10MRGPRX4BRAF
SCHEMBL1825932 0.92 S1PR1 (0.50) KDM4EHSD17B10BRAFKDRS1PR1
SCHEMBL1826718 0.91 KDM4E (0.45) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1827007 0.90 MRGPRX4 (0.53) KDM4EHSD17B10F10MRGPRX4MEN1
SCHEMBL1825497 0.90 KDM4E (0.47) KDM4EHSD17B10F10MRGPRX4MEN1

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 10 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

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 1370/4885F10 148/4885
US-20100029767-A1 ANTHRANILIC ACID DERIVATIVES ACOX3, BCL3, AOC3 KDM4E 4172/4885HSD17B10 1349/4885F10 150/4885

“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.