SCHEMBL6001396

SCHEMBL6001396

CCc1ccc(-c2nc3c(N4CCN(CCOc5ccc(NC(=O)c6c(Cl)cccc6Cl)cc5)CC4)cccc3[nH]2)cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 10/20 0.57
DRD2 P14416 6/20 0.51
DRD3 P35462 5/20 0.51
PARP1 P09874 2/20 0.48
DHODH Q02127 1/20 0.48
HTR2A P28223 2/20 0.47
CDK2 P24941 1/20 0.43
PRKCZ Q05513 1/20 0.43
HTR1A P08908 1/20 0.42

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
SCHEMBL6001578 0.91 GNRHR (0.58) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5999615 0.91 GNRHR (0.61) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5503850 0.91 GNRHR (0.57) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5511248 0.90 GNRHR (0.63) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5512568 0.90 GNRHR (0.63) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5507824 0.90 GNRHR (0.62) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5508081 0.89 GNRHR (0.61) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5506315 0.89 GNRHR (0.61) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5504511 0.89 GNRHR (0.56) GNRHRDRD2DRD3PARP1DHODH
SCHEMBL5508203 0.88 GNRHR (0.58) GNRHRDRD2DRD3PARP1DHODH

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-20060111355-A1 Gonadotropin releasing hormone receptor antagonists WYETH (US) 2006-05-25 US claimed
US-20060111355-A1 Gonadotropin releasing hormone receptor antagonists WYETH (US) 2006-05-25 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-20060111355-A1 Gonadotropin releasing hormone receptor antagonists GNRHR, LHCGR, GHRHR GNRHR 1/4885DRD2 740/4885DRD3 651/4885

“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.