SCHEMBL1141394

SCHEMBL1141394

Oc1ccnc2cc(Br)cnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.36
DYRK1A Q13627 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 7/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
PKM P14618 1/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 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
SCHEMBL29229344 0.80 MEN1 (0.38) DYRK1AKDM4EKMT2AMEN1MAPT
SCHEMBL7008476 0.80 HTT (0.39) HTTDYRK1ACYP1A2CYP2C19KDM4E
SCHEMBL1932180 0.77 HTT (0.41) HTTDYRK1ACYP1A2CYP2C19KMT2A
SCHEMBL1932691 0.77 HTT (0.36) HTTDYRK1ACYP1A2CYP2C19KDM4E
SCHEMBL2698318 0.77 HSP90AA1 (0.34) HTTKDM4EMAPTSMN1; SMN2TP53
SCHEMBL13313448 0.77 KDM4E (0.53) HTTCYP1A2KDM4EKMT2AMEN1
SCHEMBL15272132 0.77 KDM4E (0.34) KDM4EKMT2AMEN1MAPTTDP1
SCHEMBL16039310 0.74 NSD1 (0.39) HTTCYP1A2CYP2C19KDM4EKMT2A
SCHEMBL24253016 0.73 DYRK1A (0.36) HTTDYRK1AKMT2AMEN1MAPT
SCHEMBL30467712 0.73 DYRK1A (0.36) HTTDYRK1AKMT2AMEN1MAPT

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12150937-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC. (US) 2024-11-26 US disclosed
EP-3911417-B1 HETEROCYCLIC NLRP3 MODULATORS , FOR USE IN THE TREATMENT OF CANCER INNATE TUMOR IMMUNITY INC (US) 2022-10-26 EP disclosed
US-20220087991-A1 NLRP3 MODULATORS INNATE TUMOR IMMUNITY INC (US) 2022-03-24 US disclosed
US-20220087991-A1 NLRP3 MODULATORS INNATE TUMOR IMMUNITY INC (US) 2022-03-24 US disclosed
EP-3911417-A1 HETEROCYCLIC NLRP3 MODULATORS, FOR USE IN THE TREATMENT OF CANCER Innate Tumor Immunity, Inc. (US) 2021-11-24 EP disclosed
CN-113301962-A Heterocyclic NLRP3 modulators for the treatment of cancer 先天肿瘤免疫公司 2021-08-24 CN disclosed
WO-2020150114-A1 HETEROCYCLIC NLRP3 MODULATORS, FOR USE IN THE TREATMENT OF CANCER INNATE TUMOR IMMUNITY, INC. (US) 2020-07-23 WO disclosed
WO-2020150114-A1 HETEROCYCLIC NLRP3 MODULATORS, FOR USE IN THE TREATMENT OF CANCER INNATE TUMOR IMMUNITY, INC. (US) 2020-07-23 WO disclosed
US-20180222906-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2018-08-09 US disclosed
US-9938275-B2 Substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-04-10 US disclosed
US-20070066639-A1 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2007-03-22 US disclosed
WO-2006091647-A2 METHOD OF PREFERENTIALLY INDUCING THE BIOSYNTHESIS OF INTERFERON COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-08-31 WO disclosed
WO-2006091568-A2 HYDROXYALKYL SUBSTITUTED IMIDAZONAPHTHYRIDINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-08-31 WO disclosed
EP-1653914-A2 OXIME SUBSTITUTED IMIDAZO-CONTAINING COMPOUNDS 3M Innovative Properties Company (US) 2006-05-10 EP disclosed
EP-1653955-A2 HYDROXYLAMINE SUBSTITUTED IMIDAZO-CONTAINING COMPOUNDS 3M Innovative Properties Company (US) 2006-05-10 EP disclosed
WO-2006038923-A2 ARYL SUBSTITUTED IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-04-13 WO disclosed
WO-2006028545-A2 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO disclosed
WO-2005123080-A2 NITROGEN-CONTAINING HETEROCYCLYL SUBSTITUTED IMIDAZOQUINOLINES AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-12-29 WO disclosed
WO-2005018551-A2 OXIME SUBSTITUTED IMIDAZO-CONTAINING COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-03 WO disclosed
WO-2005018556-A2 HYDROXYLAMINE SUBSTITUTED IMIDAZO-CONTAINING COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-03-03 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-20180222906-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES IL2, IFNG, IL4 HTT 3601/4885DYRK1A 4339/4885CYP1A2 1619/4885
US-20220087991-A1 NLRP3 MODULATORS NLRP3, NLRP1, PYCARD HTT 2959/4885DYRK1A 4867/4885CYP1A2 558/4885
US-20070066639-A1 Oxime substituted imidazoquinolines IFNG, IRF3, IL2 HTT 4792/4885DYRK1A 3121/4885CYP1A2 303/4885
US-12150937-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD HTT 2959/4885DYRK1A 4867/4885CYP1A2 558/4885

“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.