SCHEMBL17870799

SCHEMBL17870799

Cc1ncccc1-c1cn(C(c2ccccc2)c2ccccc2)c(=O)n(C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ VHL P40337 1/20 0.41
▸ MET P08581 2/20 0.38
▸ FEN1 P39748 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ BRD4 O60885 4/20 0.36
▸ HTR2A P28223 1/20 0.35
▸ GRM4 Q14833 1/20 0.35
▸ KAT2B Q92831 2/20 0.34
▸ KAT2A Q92830 1/20 0.34
▸ GNRHR P30968 1/20 0.34
▸ TACR1 P25103 2/20 0.33

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
SCHEMBL17870731 0.79 GRM4 (0.40) MAPTBRD4HTR2AGRM4
SCHEMBL17870808 0.79 CYP17A1 (0.37) BRD4HTR2A
SCHEMBL19873784 0.79 GNRHR (0.39) MAPTHTR2AGNRHR
SCHEMBL30178497 0.79 GNRHR (0.39) MAPTHTR2AGNRHR
SCHEMBL15538152 0.78 BRD4 (0.46) METMAPTBRD4HTR2A
SCHEMBL19873895 0.77 HTR2A (0.34) METMAPTBRD4HTR2A
SCHEMBL19873692 0.75 HTR2A (0.37) METMAPTHTR2A
SCHEMBL19873779 0.71 GAA (0.53) MAPTBRD4HTR2A
SCHEMBL19873892 0.71 MAPT (0.33) MAPTHTR2A
SCHEMBL17870828 0.70 BACE1 (0.37) MAPTHTR2A

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 7 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
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
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
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

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 VHL 1631/4885MET 3272/4885FEN1 4125/4885
US-10246422-B2 Heterocyclic compounds and use thereof in medicine and in cosmetics MC1R, BDKRB2, CCKBR VHL 1643/4885MET 3244/4885FEN1 4364/4885

“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.

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