SCHEMBL17870804

SCHEMBL17870804

C[S+]([O-])CCn1c(=O)c(-c2cccc(F)c2Cl)cn(CC(=O)O)c1=O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 18/20 0.41
CYP3A4 P08684 10/20 0.41
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL30178487 1.00 GNRHR (0.41) GNRHRCYP3A4MEN1KMT2A
SCHEMBL30178503 0.90 GNRHR (0.40) GNRHRCYP3A4MEN1KMT2A
SCHEMBL28638881 0.89 GNRHR (0.40) GNRHRCYP3A4MEN1KMT2A
SCHEMBL28663465 0.89 GNRHR (0.41) GNRHRCYP3A4MEN1KMT2A
SCHEMBL19873689 0.86 GNRHR (0.44) GNRHRCYP3A4MEN1KMT2A
SCHEMBL19873709 0.86 GNRHR (0.39) GNRHRCYP3A4MEN1KMT2A
SCHEMBL30178309 0.86 GNRHR (0.39) GNRHRCYP3A4MEN1KMT2A
SCHEMBL28927223 0.85 GNRHR (0.39) GNRHRCYP3A4
SCHEMBL19873767 0.84 GNRHR (0.45) GNRHRCYP3A4MEN1KMT2A
SCHEMBL30178539 0.84 GNRHR (0.45) GNRHRCYP3A4MEN1KMT2A

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-3708566-B1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2023-02-08 EP disclosed
EP-3708566-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2020-09-16 EP disclosed
EP-3237403-B1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2020-05-06 EP disclosed
EP-3237403-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2017-11-01 EP disclosed
WO-2016102882-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-06-30 WO disclosed