SCHEMBL2298545

SCHEMBL2298545

CC(C)(C)OC(=O)N1CC(CC(=O)NNC(=O)Nc2ccc(Br)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 10/20 0.54
FPR3 P25089 6/20 0.48
KMT2A Q03164 5/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
NAMPT P43490 1/20 0.43
MEN1 O00255 3/20 0.42
KDM4E B2RXH2 1/20 0.42
USP30 Q70CQ3 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 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
SCHEMBL2297057 0.84 USP30 (0.50) FPR2NPC1RAB9ANAMPTUSP30
SCHEMBL2298548 0.83 KIT (0.43) FPR2KMT2ANPC1RAB9AMEN1
SCHEMBL2298347 0.80 KMT2A (0.51) KMT2ANPC1RAB9ANAMPTMEN1
SCHEMBL16825852 0.80 FPR2 (0.63) FPR2FPR3KMT2ANPC1RAB9A
SCHEMBL24381746 0.79 FPR2 (0.66) FPR2FPR3KMT2ANPC1RAB9A
SCHEMBL26087546 0.77 LMNA (0.45) KMT2APTPN2PTPN1PTPN6NAMPT
SCHEMBL14151538 0.76 KMT2A (0.50) FPR2KMT2ANPC1RAB9ANAMPT
SCHEMBL14720195 0.76 USP30 (0.55) FPR2NPC1NAMPTUSP30POLB
SCHEMBL14342873 0.76 GPR183 (0.44) FPR2KMT2ANPC1RAB9AMEN1
SCHEMBL2299286 0.75 KMT2A (0.48) FPR2KMT2ANPC1RAB9ANAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340529-B2 Triazolones as fatty acid synthase inhibitors GLAXOSMITHKLINE LLC (US) 2016-05-17 US disclosed
US-8802864-B2 Triazolones as fatty acid synthase inhibitors GLAXOSMITHKLINE LLC (US) 2014-08-12 US disclosed
US-20140100213-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-04-10 US disclosed
EP-2538787-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline LLC (US) 2013-01-02 EP disclosed
US-20120316151-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2012-12-13 US disclosed
WO-2011103546-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-08-25 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-20140100213-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FPR2 1091/4885FPR3 866/4885KMT2A 2550/4885
US-20120316151-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 FPR2 1055/4885FPR3 966/4885KMT2A 3059/4885

“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.