SCHEMBL12850583

SCHEMBL12850583

O=C(O)CC1Oc2cc(F)ccc2NC1=O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.51
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.46
GAA P10253 2/20 0.44
USP2 O75604 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.43
KMT2A Q03164 5/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 4/20 0.41

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
SCHEMBL30015754 0.83 KMT2A (0.47) TP53ALDH1A1HSD17B10MAPK1GAA
SCHEMBL28923516 0.83 KMT2A (0.47) TP53ALDH1A1HSD17B10MAPK1GAA
SCHEMBL7466727 0.82 L3MBTL1 (0.53) TP53ALDH1A1MAPK1GAAUSP2
SCHEMBL17434273 0.80 ALDH1A1 (0.60) ALDH1A1HSD17B10MAPK1GAAUSP2
SCHEMBL17434276 0.80 ALDH1A1 (0.60) ALDH1A1HSD17B10MAPK1GAAUSP2
SCHEMBL5670842 0.80 ALDH1A1 (0.65) TP53ALDH1A1HSD17B10MAPK1GAA
SCHEMBL26121632 0.78 IDO1 (0.44) TP53ALDH1A1HSD17B10MAPK1GAA
SCHEMBL26121628 0.78 IDO1 (0.44) TP53ALDH1A1HSD17B10MAPK1GAA
SCHEMBL26121623 0.78 IDO1 (0.44) TP53ALDH1A1HSD17B10MAPK1GAA
Hydrochloric Acid SCHEMBL30556925 0.77 IDO1 (0.43) TP53ALDH1A1HSD17B10MAPK1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2686306-B1 BENZO[B][1,4]OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN ATLANTIS HOLDINGS SA (CH) 2017-01-04 EP disclosed
EP-2686306-B1 BENZO[B][1,4]OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN ATLANTIS HOLDINGS SA (CH) 2017-01-04 EP disclosed
US-9464063-B2 Benzo [B] [1,4] oxazin derivatives as calcium sensing receptor modulators LUPIN ATLANTIS HOLDINGS SA (CH) 2016-10-11 US disclosed
US-9464063-B2 Benzo [B] [1,4] oxazin derivatives as calcium sensing receptor modulators LUPIN ATLANTIS HOLDINGS SA (CH) 2016-10-11 US disclosed
US-9464063-B2 Benzo [B] [1,4] oxazin derivatives as calcium sensing receptor modulators LUPIN ATLANTIS HOLDINGS SA (CH) 2016-10-11 US disclosed
US-20140018358-A1 BENZO [B] [1,4] OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2014-01-16 US disclosed
US-20140018358-A1 BENZO [B] [1,4] OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2014-01-16 US disclosed
US-20140018358-A1 BENZO [B] [1,4] OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2014-01-16 US disclosed
WO-2012127388-A1 BENZO [B] [1, 4] OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2012-09-27 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 (1 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-20140018358-A1 BENZO [B] [1,4] OXAZIN DERIVATIVES AS CALCIUM SENSING RECEPTOR MODULATORS CASR, RYR1, RYR2 TP53 4351/4885ALDH1A1 2490/4885HSD17B10 2051/4885

“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.