SCHEMBL5451256

SCHEMBL5451256

CNC(=O)c1ccc(Oc2ccc(-c3ccc4c(c3)CCN(C(=O)OC(C)(C)C)CC4)cc2)nc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.57
GPR119 Q8TDV5 3/20 0.49
S1PR2 O95136 1/20 0.47
HRH1 P35367 1/20 0.43
ESR2 Q92731 1/20 0.41
OPRM1 P35372 4/20 0.41
OPRD1 P41143 4/20 0.41
OPRK1 P41145 2/20 0.41
NR1H2 P55055 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LIPE Q05469 1/20 0.40

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
SCHEMBL3077276 0.93 HRH3 (0.66) HRH3GPR119S1PR2HRH1ESR2
SCHEMBL4913618 0.82 HRH3 (0.52) HRH3ESR2OPRM1OPRD1OPRK1
SCHEMBL4913611 0.82 OPRM1 (0.52) HRH3ESR2OPRM1OPRD1OPRK1
SCHEMBL5662459 0.82 GPR119 (0.48) HRH3GPR119S1PR2ESR2NR1H2
SCHEMBL3100067 0.82 HRH3 (0.48) HRH3GPR119S1PR2ESR2NR1H2
SCHEMBL5452228 0.81 HRH3 (0.86) HRH3HRH1
SCHEMBL3089265 0.80 HRH3 (0.66) HRH3S1PR2HRH1ESR2OPRM1
SCHEMBL14642250 0.79 HRH3 (0.65) HRH3HRH1OPRM1OPRD1OPRK1
SCHEMBL5458760 0.79 CRBN (0.52) GPR119S1PR2ESR2NR1H2NPC1
SCHEMBL5661913 0.78 GPR119 (0.47) HRH3GPR119S1PR2ESR2NR1H2

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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US disclosed
EP-1730114-A1 BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2006-12-13 EP disclosed
WO-2005087746-A1 BENZAZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2005-09-22 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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B HRH3 38/4885GPR119 1092/4885S1PR2 1297/4885

“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.