SCHEMBL7956493

SCHEMBL7956493

CON(O)C(=O)Nc1ccc(-c2sc3c(c2CN(C)Cc2ccccc2)c(=O)c(C(=O)C(C)C)cn3Cc2c(F)cccc2F)cc1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.82
MEN1 O00255 1/20 0.72
KMT2A Q03164 1/20 0.72

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
SCHEMBL7833581 0.93 GNRHR (0.89) GNRHRMEN1KMT2A
SCHEMBL7006144 0.90 GNRHR (1.00) GNRHRMEN1KMT2A
SCHEMBL5138669 0.90 GNRHR (0.86) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7497376 0.90 GNRHR (0.99) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7833128 0.89 GNRHR (0.85) GNRHRMEN1KMT2A
SCHEMBL7005389 0.89 GNRHR (1.00) GNRHRMEN1KMT2A
SCHEMBL7828327 0.89 GNRHR (1.00) GNRHRMEN1KMT2A
SCHEMBL7006717 0.89 GNRHR (0.89) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7498171 0.89 GNRHR (0.88) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7826617 0.89 GNRHR (0.99) GNRHRMEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6297255-B1 GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-02 US claimed
US-6329388-B2 GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; USEFUL FOR PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES, E.G., SEX HORMONE-DEPENDENT CANCERS (E.G., PROSTATIC CANCER, UTERINE CANCER, BREAST CANCER, PITUITARY TUMOR) TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-11 US disclosed
US-6297255-B1 GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-02 US disclosed