SCHEMBL15567283

SCHEMBL15567283

C#CCN1C(=O)C(F)(F)Oc2cc(F)c(NC(=O)Oc3ccccc3)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAOB P27338 2/20 0.37
BCHE P06276 1/20 0.36
ALDH1A1 P00352 6/20 0.35
POLB P06746 1/20 0.34
GAA P10253 2/20 0.34
CYP1A2 P05177 1/20 0.34
ACHE P22303 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL12168471 0.85 ALDH1A1 (0.32) ALDH1A1POLBGAAKMT2AMEN1
SCHEMBL12098094 0.85 ALDH1A1 (0.32) ALDH1A1POLBGAAKMT2AMEN1
SCHEMBL1802016 0.83 ALDH1A1 (0.37) MAOBALDH1A1CYP1A2MAPTKDM4E
SCHEMBL901186 0.76 HTT (0.32) GLA
SCHEMBL15567945 0.74 NPC1 (0.44) NPC1RAB9ANPSR1MAOBALDH1A1
SCHEMBL900905 0.72
SCHEMBL900513 0.72
SCHEMBL20591011 0.71 MAOA (0.35) MAOBALDH1A1GAA
SCHEMBL20693092 0.70 PARP1 (0.34) ALDH1A1GAAKMT2AKDM4EHPGD
SCHEMBL2606236 0.69 PGR (0.35) ALDH1A1GAAMAPT

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
EP-2885281-B1 CARBAMAT-BENZOXAZINONES USEFUL FOR PREPARING TRIAZIN-BENZOXAZINONES BASF SE (DE) 2016-12-07 EP disclosed
EP-2885281-B1 CARBAMAT-BENZOXAZINONES USEFUL FOR PREPARING TRIAZIN-BENZOXAZINONES BASF SE (DE) 2016-12-07 EP disclosed
US-9409894-B2 Carbamates BASF SE (DE) 2016-08-09 US disclosed
US-9409894-B2 Carbamates BASF SE (DE) 2016-08-09 US disclosed
US-9409894-B2 Carbamates BASF SE (DE) 2016-08-09 US disclosed
EP-2885296-B1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2016-06-29 EP disclosed
EP-2885296-B1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2016-06-29 EP disclosed
US-20150218140-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2015-08-06 US disclosed
US-20150218140-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2015-08-06 US disclosed
US-20150218140-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2015-08-06 US disclosed
US-20150218139-A1 CARBAMATES BASF SE (DE) 2015-08-06 US disclosed
EP-2885296-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2015-06-24 EP disclosed
EP-2885272-A1 CARBAMATES BASF SE (DE) 2015-06-24 EP disclosed
EP-2885281-A1 CARBAMAT-BENZOXAZINONES BASF SE (DE) 2015-06-24 EP disclosed
WO-2014026845-A1 CARBAMATES BASF SE (DE) 2014-02-20 WO disclosed
WO-2014026893-A1 CARBAMAT-BENZOXAZINONES BASF SE (DE) 2014-02-20 WO disclosed
WO-2014026928-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES BASF SE (DE) 2014-02-20 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-20150218140-A1 PROCESS FOR MANUFACTURING BENZOXAZINONES CYP4X1, CYP3A5, CYP2B6 NPC1 3213/4885RAB9A 2775/4885NPSR1 2226/4885
US-20150218139-A1 CARBAMATES CYP4X1, CYP2B6, CBX7 NPC1 2667/4885RAB9A 1962/4885NPSR1 1808/4885

“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.