SCHEMBL4869320

SCHEMBL4869320

Cc1cc(C)cc(-c2[nH]c3ccc(C(C)(C)C(=O)N4C5CCC4CC5)cc3c2[C@H](C)CN/C(=N\C(=O)O)N2CCC(c3ccncc3)C2)c1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 19/20 0.63
CYP3A4 P08684 1/20 0.56
CACNA1B Q00975 1/20 0.55

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
SCHEMBL4869326 1.00 GNRHR (0.63) GNRHRCYP3A4CACNA1B
SCHEMBL4869348 0.93 GNRHR (0.66) GNRHRCYP3A4
SCHEMBL4869340 0.93 GNRHR (0.66) GNRHRCYP3A4
SCHEMBL14006561 0.93 GNRHR (0.61) GNRHRCYP3A4CACNA1B
SCHEMBL5132615 0.87 GNRHR (0.79) GNRHRCYP3A4
SCHEMBL14006554 0.86 GNRHR (0.64) GNRHRCYP3A4
SCHEMBL4868762 0.83 GNRHR (0.59) GNRHRCYP3A4
SCHEMBL4868782 0.83 GNRHR (0.59) GNRHRCYP3A4
SCHEMBL14006588 0.83 GNRHR (0.59) GNRHRCYP3A4
SCHEMBL14006596 0.83 GNRHR (0.69) GNRHRCYP3A4

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-7449489-B2 Indolylalkylamino-methylidenecarbamate derivatives useful as GnRH antagonists ASTRAZENECA AB (SE) 2008-11-11 US claimed
US-20060258710-A1 Indolylalkylamino-methylidenecarbamate derivatives useful as gnrh antagonists ASTRAZENECA AB (SE) 2006-11-16 US claimed
US-7449489-B2 Indolylalkylamino-methylidenecarbamate derivatives useful as GnRH antagonists ASTRAZENECA AB (SE) 2008-11-11 US disclosed
US-20060258710-A1 Indolylalkylamino-methylidenecarbamate derivatives useful as gnrh antagonists ASTRAZENECA AB (SE) 2006-11-16 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-20060258710-A1 Indolylalkylamino-methylidenecarbamate derivatives useful as gnrh antagonists GNRHR, GHRHR, PRLHR GNRHR 1/4885CYP3A4 2120/4885CACNA1B 1145/4885

“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.