SCHEMBL5364868

SCHEMBL5364868

O=C1c2cccc(N3CCNCC3)c2Oc2cc(F)ccc2N1Cc1cccc(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.69
EGFR P00533 4/20 0.45
UBE2N P61088 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
CASP6 P55212 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH3A1 P30838 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
NR3C2 P08235 1/20 0.39

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
SCHEMBL5364738 0.93 HTR6 (0.79) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5356843 0.93 HTR6 (0.70) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5357019 0.90 HTR6 (0.64) HTR6LMNAMAPTSMN1; SMN2MEN1
SCHEMBL5372213 0.87 HTR6 (0.68) HTR6LMNAMAPTSMN1; SMN2MEN1
SCHEMBL5356074 0.86 HTR6 (0.59) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5366505 0.86 HTR6 (0.74) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5364715 0.85 HTR6 (0.82) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5360955 0.84 HTR6 (0.80) HTR6EGFRUBE2NTDP1LMNA
SCHEMBL5361156 0.84 HTR6 (0.68) HTR6EGFRUBE2NLMNAHPGD
SCHEMBL5362209 0.84 HTR6 (0.61) HTR6EGFRMAPTSMN1; SMN2ALDH3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229984-B2 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2007-06-12 US claimed
US-20060154914-A1 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC 2006-07-13 US claimed
US-7229984-B2 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2007-06-12 US disclosed
US-7229984-B2 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2007-06-12 US disclosed
US-7229984-B2 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2007-06-12 US disclosed
US-20060154914-A1 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC 2006-07-13 US disclosed
WO-2006061126-A2 DIBENZOXAZEPINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-06-15 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-20060154914-A1 Dibenzoxazepinone derivatives and uses thereof HTR6, BDKRB1, HTR7 HTR6 1/4885EGFR 1718/4885UBE2N 2414/4885

“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.