SCHEMBL4336512

SCHEMBL4336512

Cn1cnc2ccc(CO)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.47
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 1/20 0.42
CACNA1G O43497 1/20 0.42
CACNA1H O95180 1/20 0.42
CACNA1I Q9P0X4 1/20 0.42
GFER P55789 2/20 0.41
NOTUM Q6P988 2/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 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
SCHEMBL541672 0.86 NPC1 (0.52) NPC1RAB9AALDH1A1KDM4EGAA
SCHEMBL8738054 0.84 NPC1 (0.54) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL21385023 0.82 DYRK1A (0.47) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL31361379 0.82 DYRK1A (0.47) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL20946380 0.82 DYRK1A (0.51) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL29305737 0.81 DYRK1A (0.46) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL17316745 0.80 ALDH1A1 (0.51) DYRK1AALDH1A1KDM4EGAAHSD17B10
SCHEMBL29306045 0.80 CACNA1G (0.49) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL24244659 0.79 DYRK1A (0.45) DYRK1ANPC1RAB9AALDH1A1KDM4E
SCHEMBL25941136 0.79 DYRK1A (0.45) DYRK1ANPC1RAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999232-B MAT2A inhibitors 南京正大天晴制药有限公司 2025-01-07 CN disclosed
US-20230322744-A1 COMPOUNDS AS GLP-1R AGONISTS TERNS PHARMACEUTICALS, INC. 2023-10-12 US disclosed
US-20230322744-A1 COMPOUNDS AS GLP-1R AGONISTS TERNS PHARMACEUTICALS, INC. 2023-10-12 US disclosed
CN-116507326-A Compounds as GLP-1R agonists 拓臻制药公司 2023-07-28 CN disclosed
WO-2023000834-A1 BENZIMIDAZOLE OR AZABENZIMIDAZOLE-6-CARBOXYLIC ACID COMPOUND AND USE THEREOF 广州必贝特医药股份有限公司 2023-01-26 WO disclosed
CN-113480534-B Benzimidazole or azabenzimidazole-6-carboxylic acid compounds and application thereof 广州必贝特医药股份有限公司 2022-05-13 CN disclosed
WO-2022040600-A1 COMPOUNDS AS GLP-1R AGONISTS TERNS PHARMACEUTICALS, INC. (US) 2022-02-24 WO disclosed
CN-113480534-A Benzimidazole or azabenzimidazole-6-carboxylic acid compounds and application thereof 广州必贝特医药技术有限公司 2021-10-08 CN disclosed
EP-3768670-A1 IMIDAZOLIDIN-2-ONE COMPOUNDS AS PRMT5 MODULATORS Aurigene Discovery Technologies Limited (IN) 2021-01-27 EP disclosed
WO-2019180628-A1 IMIDAZOLIDIN-2-ONE COMPOUNDS AS PRMT5 MODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2019-09-26 WO disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP 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-20230322744-A1 COMPOUNDS AS GLP-1R AGONISTS GLP1R, GIPR, GCGR DYRK1A 750/4885NPC1 690/4885RAB9A 737/4885
US-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 DYRK1A 2777/4885NPC1 603/4885RAB9A 2956/4885

“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.