SCHEMBL5357553

SCHEMBL5357553

CC(C)(C)C1CN(c2cccc3c2Oc2ccccc2NC3=O)CCN1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CHRM2 P08172 4/20 0.34
CHRM4 P08173 4/20 0.34
CHRM1 P11229 4/20 0.34
CHRM3 P20309 4/20 0.34
MAPT P10636 3/20 0.33
BACE1 P56817 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTR1A P08908 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX5 P09917 1/20 0.32

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
SCHEMBL5945010 0.77 BACE1 (0.50) MAPTBACE1
SCHEMBL5359537 0.74 ADRB1 (0.49) HTR1A
Hydrochloric Acid SCHEMBL5361148 0.74 ADRB1 (0.48) HTR1A
SCHEMBL5364887 0.74 DRD2 (0.55) MAPTTDP1L3MBTL1HTR1A
SCHEMBL5357397 0.72 SMN1; SMN2 (0.44) MEN1KMT2AMAPTBACE1L3MBTL1
SCHEMBL4558300 0.71 SLC6A9 (0.44) HTR1A
SCHEMBL30881604 0.71 ADRA2C (0.45) MEN1KMT2AMAPTPOLBGAA
SCHEMBL17491559 0.71 ADRA2C (0.45) MEN1KMT2AMAPTPOLBGAA
SCHEMBL21900286 0.71 SLC6A7 (0.36) MEN1KMT2AMAPTHTR1APOLB
SCHEMBL2327343 0.70 RBP4 (0.37) MEN1KMT2APOLB

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 2 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 disclosed
US-20060154914-A1 Dibenzoxazepinone derivatives and uses thereof ROCHE PALO ALTO LLC 2006-07-13 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 (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 MEN1 1588/4885KMT2A 1848/4885CHRM2 71/4885

“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.