SCHEMBL7997233

SCHEMBL7997233

[CH2]Cc1c(-c2cc(C)cc(C)c2)[nH]c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 1/20 0.50

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
SCHEMBL8689808 0.81 CYP3A4 (0.64) GNRHR
SCHEMBL7995810 0.81 GNRHR (0.54) GNRHR
SCHEMBL27686168 0.81 HTR2A (0.58)
Trimethylammonium SCHEMBL8695107 0.80 HTR2A (0.51) GNRHR
SCHEMBL8692594 0.80 GNRHR (0.56) GNRHR
Iodide SCHEMBL8695111 0.80 GNRHR (0.47) GNRHR
SCHEMBL4423600 0.75 MAPT (0.65)
SCHEMBL8694550 0.75 TLR8 (0.53)
SCHEMBL30047453 0.74 NR1I3 (0.51)
SCHEMBL28906384 0.74 NR1I3 (0.51)

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
EP-0868178-A4 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO INC (US) 2000-03-29 EP claimed
EP-0868178-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1998-10-07 EP claimed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US claimed
WO-1997021435-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-06-19 WO claimed
US-5756507-A TREATING SEX HORMONE RELATED DISORDERS MERCK & CO., INC. (US) 1998-05-26 US disclosed