SCHEMBL8690368

SCHEMBL8690368

CCNc1c(-c2cc(C)cc(C)c2)[nH]c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.43

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
SCHEMBL8692600 0.88 GNRHR (0.44) GNRHR
SCHEMBL8695361 0.79 PTGS2 (0.43) GNRHR
SCHEMBL8698485 0.78 MAPT (0.46)
Hydrochloric Acid SCHEMBL8699214 0.77 MAPT (0.45)
SCHEMBL7997233 0.72 GNRHR (0.50) GNRHR
SCHEMBL8689808 0.70 CYP3A4 (0.64) GNRHR
SCHEMBL7995810 0.70 GNRHR (0.54) GNRHR
Trimethylammonium SCHEMBL8695107 0.69 HTR2A (0.51) GNRHR
SCHEMBL8692594 0.69 GNRHR (0.56) GNRHR
Iodide SCHEMBL8695111 0.69 GNRHR (0.47) GNRHR

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-5849764-A Antagonists of gonadotropin releasing hormone MERCK & CO., INC. (US) 1998-12-15 US disclosed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed