SCHEMBL4481975

SCHEMBL4481975

O=C1c2ccc(C(F)(F)F)cc2OC[C@H]2CCCN12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.49
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
GAA P10253 4/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
HTR2B P41595 2/20 0.46
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GRIA1 P42261 1/20 0.40
NPSR1 Q6W5P4 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
ALPL P05186 2/20 0.39
PRMT5 O14744 1/20 0.38

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
SCHEMBL4704066 1.00 AR (0.49) ARKMT2AMEN1GAAMAPT
SCHEMBL4701384 0.96 AR (0.50) ARKMT2AMEN1GAAMAPT
SCHEMBL4484222 0.91 KMT2A (0.46) ARKMT2AMEN1GAAMAPT
SCHEMBL14481095 0.84 AR (0.43) ARKMT2AMEN1GAAMAPT
SCHEMBL14480619 0.84 AR (0.43) ARKMT2AMEN1GAAMAPT
SCHEMBL21780397 0.84 AR (0.43) ARKMT2AMEN1GAAMAPT
SCHEMBL4477728 0.83 AR (0.44) ARGRIA1ALPLPRMT5WDR77
SCHEMBL4489426 0.80 ALPL (0.47) ARHTR2AHTR2CHTR2BGRIA1
SCHEMBL4483125 0.80 ALPL (0.47) ARHTR2AHTR2CHTR2BGRIA1
SCHEMBL4472275 0.79 AR (0.45) ARKMT2AMEN1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504390-B2 Benzoxazepine derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2009-03-17 US disclosed
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS N.V. ORGANON (NL) 2008-06-12 US disclosed
EP-1399450-B1 BENZOXAZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS ORGANON NV (NL) 2008-03-19 EP disclosed
US-7307073-B2 Benzoxazepines derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2007-12-11 US disclosed
US-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators MERCK SHARP & DOHME B.V. (NL) 2004-09-02 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-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators CHRNA4, CHRNA10, CHRNA9 AR 914/4885KMT2A 2555/4885MEN1 4866/4885
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS GRIN1, GRIA4, CHRNA4 AR 978/4885KMT2A 2258/4885MEN1 4584/4885

“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.