SCHEMBL3146940

SCHEMBL3146940

COc1cc2c(cc1OC)CCN(C(=O)CCNCC1Cc3cc(OC(=O)N4CC5CCCC5C4)ccc31)CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ABCB1 P08183 2/20 0.37
ABCC1 P33527 1/20 0.36
PDE4B Q07343 2/20 0.36
PDE4D Q08499 1/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 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
SCHEMBL3163086 0.91 DPP4 (0.45) DPP4DPP8KMT2ASMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL4253272 0.90 DPP4 (0.44) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3267375 0.87 SMN1; SMN2 (0.46) DPP4DPP8KMT2ASMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL4243050 0.86 SMN1; SMN2 (0.45) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3163299 0.86 CHRM2 (0.44) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3144868 0.86 DPP4 (0.41) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3162393 0.85 ABCB1 (0.46) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3152625 0.84 DPP4 (0.43) DPP4DPP8KMT2ASMN1; SMN2RAB9A
SCHEMBL3149457 0.84 KMT2A (0.45) DPP4DPP8KMT2ASMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL4247185 0.84 DPP4 (0.42) DPP4DPP8KMT2AABCB1ABCC1

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 4 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
EP-2036892-B1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2010-03-10 EP disclosed
EP-2036892-A1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2009-03-18 EP 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 DPP4 3477/4885DPP8 4108/4885KMT2A 1570/4885

“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.