SCHEMBL6478281

SCHEMBL6478281

NC(Cc1ccccc1)n1c(=O)c(Cc2c(F)cccc2F)nn(-c2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 12/20 0.50
AR P10275 1/20 0.37
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 2/20 0.33
RARG P13631 1/20 0.33
RORC P51449 1/20 0.33
CTSK P43235 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL6477952 0.81 GNRHR (0.52) GNRHRARLMNA
SCHEMBL6478276 0.76 GNRHR (0.82) GNRHR
SCHEMBL6478279 0.76 GNRHR (0.82) GNRHR
SCHEMBL6476129 0.72 ALDH1A1 (0.40) GNRHRTP53MAPTLMNAALDH1A1
SCHEMBL6476891 0.68 AR (0.47) GNRHRARALDH1A1ADORA3
SCHEMBL6476552 0.67 GNRHR (1.00) GNRHR
SCHEMBL6489326 0.65 GNRHR (0.59) GNRHR
SCHEMBL6477411 0.64 GNRHR (0.85) GNRHR
SCHEMBL6485600 0.63 GNRHR (0.72) GNRHR
SCHEMBL6478272 0.62 CES2 (0.34) GNRHRLMNA

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-6951858-B2 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2005-10-04 US disclosed
US-20050075339-A1 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. (US) 2005-04-07 US disclosed
US-6673796-B2 SEXUAL DISORDERS NEUROCRINE BIOSCIENCES, INC. 2004-01-06 US disclosed
US-20030114455-A1 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto NEUROCRINE BIOSCIENCES, INC. 2003-06-19 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 (2 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-20030114455-A1 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto GNRHR, GHRHR, LHCGR GNRHR 1/4885AR 57/4885TP53 4090/4885
US-20050075339-A1 Gonadotropin-releasing hormone receptor antagonists and methods relating thereto GNRHR, LHCGR, GHRHR GNRHR 1/4885AR 50/4885TP53 3397/4885

“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.