SCHEMBL4253490

SCHEMBL4253490

CNC(=O)COc1ccc2c(c1)CC2C(N(CCC(=O)N1CCc2cc(OC)c(OC)cc2CC1)C(=O)O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HCRTR2 O43614 7/20 0.37
HCRTR1 O43613 3/20 0.37
GPER1 Q99527 1/20 0.37
S1PR1 P21453 1/20 0.36
MTNR1B P49286 1/20 0.36
ABCB1 P08183 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL4247520 0.87 ABCB1 (0.41) KMT2AHCRTR2HCRTR1ABCB1NPC1
SCHEMBL4247541 0.85 HCRTR2 (0.41) MAPTKMT2AALDH1A1SMN1; SMN2HCRTR2
Hydrochloric Acid SCHEMBL4247360 0.80 CHRM2 (0.45) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL4247358 0.80 HCRTR2 (0.41) MAPTKMT2AALDH1A1SMN1; SMN2HCRTR2
SCHEMBL4253487 0.80 MAPT (0.41) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL4243341 0.76 MAPT (0.44) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL3155094 0.69 CHRM2 (0.47) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL4249161 0.69 CHRM2 (0.46) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL4247516 0.67 ABCB1 (0.40) MAPTKMT2AMEN1ABCB1
SCHEMBL3145228 0.66 KMT2A (0.55) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2

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-8076325-B2 1,2,4,5-tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-12-13 US disclosed
US-20090069296-A1 1,2,4,5-Tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-03-12 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-20090069296-A1 1,2,4,5-Tetrahydro-3H-benzazepine compounds, a process for their preparation and pharmaceutical compositions containing them OXER1, NR1H3, OXSR1 MAPT 2717/4885KMT2A 1570/4885MEN1 2079/4885

“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.