SCHEMBL19873689

SCHEMBL19873689

CCCn1c(=O)c(-c2cccc(F)c2Cl)cn(CC(=O)O)c1=O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 16/20 0.44
CYP3A4 P08684 10/20 0.44
ADORA2B P29275 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ADORA2A P29274 1/20 0.35

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
SCHEMBL30178539 0.91 GNRHR (0.45) GNRHRCYP3A4MEN1KMT2A
SCHEMBL19873767 0.91 GNRHR (0.45) GNRHRCYP3A4MEN1KMT2A
SCHEMBL19873682 0.88 GNRHR (0.44) GNRHRCYP3A4
SCHEMBL30178392 0.88 GNRHR (0.44) GNRHRCYP3A4
SCHEMBL17870829 0.88 GNRHR (0.42) GNRHRCYP3A4MEN1KMT2A
SCHEMBL30178400 0.88 GNRHR (0.42) GNRHRCYP3A4MEN1KMT2A
SCHEMBL30178420 0.87 GNRHR (0.43) GNRHRCYP3A4
SCHEMBL19873676 0.87 GNRHR (0.43) GNRHRCYP3A4
SCHEMBL30178503 0.87 GNRHR (0.40) GNRHRCYP3A4MEN1KMT2A
SCHEMBL17870804 0.86 GNRHR (0.41) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428744-B Novel heterocyclic compounds and their use in medicine and cosmetics 盖尔德马研究及发展公司 2021-09-24 CN disclosed
US-10246422-B2 Heterocyclic compounds and use thereof in medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2019-04-02 US disclosed
US-20180050992-A1 NOVEL HETEROCYCLIC COMPOUNDS AND USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2018-02-22 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-20180050992-A1 NOVEL HETEROCYCLIC COMPOUNDS AND USE THEREOF IN MEDICINE AND IN COSMETICS MC1R, CALCRL, BDKRB2 GNRHR 215/4885CYP3A4 2314/4885ADORA2B 346/4885
US-10246422-B2 Heterocyclic compounds and use thereof in medicine and in cosmetics MC1R, BDKRB2, CCKBR GNRHR 201/4885CYP3A4 1806/4885ADORA2B 326/4885

“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.