SCHEMBL3358360

SCHEMBL3358360

CC(=O)c1ccc(-n2cncn2)nc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 1/20 0.61
KDM4E B2RXH2 4/20 0.60
POLB P06746 1/20 0.60
MAPT P10636 2/20 0.59
KMT2A Q03164 3/20 0.56
MEN1 O00255 1/20 0.56
GLA P06280 1/20 0.56
HTT P42858 1/20 0.56
ALDH1A1 P00352 1/20 0.54
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
EGLN1 Q9GZT9 1/20 0.40

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
SCHEMBL30003409 1.00 KCNJ1 (0.61) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL600130 0.86 MAPT (0.64) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL5717534 0.84 MAPT (0.59) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL354153 0.84 KDM4E (0.66) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL26971044 0.84 MAPT (0.65) KDM4EPOLBMAPTKMT2AMEN1
SCHEMBL14376686 0.81 MAPT (0.58) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL3358083 0.77 KCNJ1 (0.57) KCNJ1KDM4EMAPTKMT2AHTT
SCHEMBL16897509 0.76 KCNJ1 (1.00) KCNJ1KMT2AALDH1A1LMNA
SCHEMBL1612695 0.76 MEN1 (0.51) KCNJ1KDM4EPOLBMAPTKMT2A
SCHEMBL1612693 0.76 MEN1 (0.51) KCNJ1KDM4EPOLBMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287070-A1 FUSED HETEROCYCLIC DERIVATIVES JOHNSON & JOHNSON (CHINA) INVESTMENT LTD. (CN) 2024-08-29 US disclosed
CN-117999075-A Compounds and pharmaceutical compositions comprising inhibitors of amyloid peptide interaction with glycosaminoglycans, methods of treatment, and uses thereof 吉斯莫治疗股份有限公司 2024-05-07 CN disclosed
WO-2022253259-A1 FUSED HETEROCYCLIC DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2022-12-08 WO disclosed
EP-2725027-B1 NOVEL COMPOUND WITH AMYLOID AFFINITY NIHON MEDIPHYSICS CO LTD (JP) 2017-03-01 EP disclosed
US-9211350-B2 Compound with amyloid affinity NIHON MEDI-PHYSICS CO., LTD. (JP) 2015-12-15 US disclosed
US-9211350-B2 Compound with amyloid affinity NIHON MEDI-PHYSICS CO., LTD. (JP) 2015-12-15 US disclosed
US-8952175-B2 Method for production of 3-hydroxypropan-1-one compound, method for production of 2-propen-1-one compound and method for production of isoxazoline compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-02-10 US disclosed
US-20140121377-A1 NOVEL COMPOUND WITH AMYLOID AFFINITY NIHON MEDI-PHYSICS CO., LTD. (JP) 2014-05-01 US disclosed
EP-2725027-A1 NOVEL COMPOUND WITH AMYLOID AFFINITY Nihon Medi-Physics Co., Ltd. (JP) 2014-04-30 EP disclosed
CN-103596950-A Novel compound with amyloid affinity NIHON MEDIPHYSICS CO LTD 2014-02-19 CN disclosed
WO-2012176587-A1 NOVEL COMPOUND WITH AMYLOID AFFINITY 日本メジフィジックス株式会社 (JP) 2012-12-27 WO disclosed
US-20100137612-A1 METHOD FOR PRODUCTION OF 3-HYDROXYPROPAN-1-ONE COMPOUND FOR PRODUCTION OF 2- PROPEN-1-ONE COMPOUND AND METHOD FOR PRODUCTION OF ISOXAZLINE COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-03 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 (3 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-20100137612-A1 METHOD FOR PRODUCTION OF 3-HYDROXYPROPAN-1-ONE COMPOUND FOR PRODUCTION OF 2- PROPEN-1-ONE COMPOUND AND METHOD FOR PRODUCTION OF ISOXAZLINE COMPOUND ADH1C, CYP2E1, ADH1A KCNJ1 268/4885KDM4E 3628/4885POLB 1538/4885
US-20240287070-A1 FUSED HETEROCYCLIC DERIVATIVES HAVCR2, HCCS, GOT2 KCNJ1 4552/4885KDM4E 3515/4885POLB 587/4885
US-20140121377-A1 NOVEL COMPOUND WITH AMYLOID AFFINITY APP, APBA1, BACE1 KCNJ1 2075/4885KDM4E 4344/4885POLB 4541/4885

“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.