SCHEMBL2715477

SCHEMBL2715477

COC(=O)c1ccnc(NC(=O)C2CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 4/20 0.47
HSD17B10 Q99714 2/20 0.46
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.44
HSP90AA1 P07900 1/20 0.44
RAB9A P51151 1/20 0.44
ABL1 P00519 1/20 0.44
GSK3B P49841 6/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
IKBKB O14920 1/20 0.43
RIPK2 O43353 1/20 0.43
JAK2 O60674 1/20 0.43
LCK P06239 1/20 0.43
TYK2 P29597 1/20 0.43

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
SCHEMBL30449743 0.85 GSK3B (0.56) POLBGSK3BHPGDRXFP1L3MBTL1
SCHEMBL2714790 0.84 KDM4E (0.61) JAK1POLBABL1GSK3BHPGD
SCHEMBL1788016 0.80 KDM4E (0.47) POLBNPC1RAB9ARXFP1KDM4E
SCHEMBL28129515 0.79 KDM4E (0.44) JAK1L3MBTL1KDM4EMAPTTSHR
SCHEMBL29155745 0.79 POLB (0.64) JAK1HSD17B10POLBNPC1RAB9A
SCHEMBL4550418 0.79 ADORA1 (0.45) JAK1POLBABL1GSK3BHPGD
SCHEMBL22186405 0.78 KDM4E (0.58) JAK1NPC1RAB9AABL1GSK3B
SCHEMBL28606159 0.78 ALDH1A1 (0.51) HSD17B10NPC1RAB9AHPGDALDH1A1
SCHEMBL23064275 0.77 HSD17B10 (0.56) JAK1HSD17B10GSK3BALDH1A1KDM4E
SCHEMBL2713731 0.77 HSD17B10 (0.49) JAK1HSD17B10NPC1HSP90AA1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12110287-B2 Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2024-10-08 US disclosed
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 CN disclosed
US-20220048892-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2022-02-17 US disclosed
EP-3902544-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RaQualia Pharma Inc. (JP) 2021-11-03 EP disclosed
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2021-10-26 US disclosed
CN-113164461-A Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2021-07-23 CN disclosed
EP-3487839-B1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC (JP) 2020-12-23 EP disclosed
WO-2020138271-A1 HETEROCYCLIC DERIVATIVES AS Nav1.7 and Nav1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2020-07-02 WO disclosed
CN-106478497-B Arylamine derivatives as TTX-S blockers 拉夸里亚创药株式会社 2020-05-08 CN disclosed
CN-110612285-A Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2019-12-24 CN disclosed
EP-3487839-A1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RaQualia Pharma Inc. (JP) 2019-05-29 EP disclosed
WO-2018235851-A1 AMIDE DERIVATIVES AS Nav1.7 and Nav1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2018-12-27 WO disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 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 (4 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-12110287-B2 Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A JAK1 4733/4885HSD17B10 1789/4885POLB 4053/4885
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A JAK1 4799/4885HSD17B10 1811/4885POLB 3813/4885
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A JAK1 4790/4885HSD17B10 2660/4885POLB 4126/4885
US-20220048892-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS SCN8A, SCN7A, SCN1A JAK1 4733/4885HSD17B10 1789/4885POLB 4053/4885

“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.