SCHEMBL570746

SCHEMBL570746

CCn1n[c]c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 6/20 0.44
GRM2 Q14416 1/20 0.36
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 1/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
MAPK1 P28482 2/20 0.32
NR1H3 Q13133 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 2/20 0.32
NPC1 O15118 1/20 0.32
HCRTR1 O43613 1/20 0.32
USP2 O75604 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL29199475 0.85 SLC9A1 (0.47) SLC9A1GRM2HTTALDH1A1CASP1
SCHEMBL29199466 0.82 SLC9A1 (0.50) SLC9A1GRM2ALDH1A1NR1H3TSHR
SCHEMBL3801864 0.80 SLC9A1 (0.51) SLC9A1GRM2
SCHEMBL570412 0.77 TDO2 (0.39) CYP1A2CYP2D6ALDH1A1MAPK1KDM4E
SCHEMBL3326163 0.77 GRM2 (0.47) SLC9A1GRM2ALDH1A1NR1H3KDM4E
SCHEMBL3663636 0.74 ALDH1A1 (0.52) HTTALDH1A1KDM4EHSD17B10TSHR
SCHEMBL3705991 0.74 GRM2 (0.42) GRM2ALDH1A1KDM4EHSD17B10L3MBTL1
SCHEMBL29141982 0.74 KDM4E (0.36) ALDH1A1MAPK1KDM4EMAPTTSHR
SCHEMBL14157278 0.72 NPC1 (0.38) NPC1
SCHEMBL570629 0.72 CDK4 (0.37) HTTALDH1A1KDM4ENPC1HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003030909-A1 2- AND 4-AMINOPYRIMIDINES N-SUBSTTITUDED BY A BICYCLIC RING FOR USE AS KINASE INHIBITORS IN THE TREATMENT OF CANCER BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-17 WO claimed
US-4132436-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1979-01-02 US claimed
CN-114213331-B URAT1 inhibitor and application thereof 江苏新元素医药科技有限公司 2024-06-21 CN disclosed
CN-110669107-B Antibacterial peptide and preparation method thereof 上海医药工业研究院 2024-04-02 CN disclosed
CN-108727267-B URAT1 inhibitor and application thereof 江苏新元素医药科技有限公司 2022-05-13 CN disclosed
CN-114213331-A URAT1 inhibitor and application thereof 江苏新元素医药科技有限公司 2022-03-22 CN disclosed
US-RE48622-E1 Therapeutically active pyrazolo-pyrimidine derivatives UCB Biopharma SRL (BE) 2021-07-06 US disclosed
EP-2935269-B1 THERAPEUTICALLY ACTIVE PYRAZOLO-PYRIMIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2018-04-11 EP disclosed
US-9714248-B2 Therapeutically active pyrazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2017-07-25 US disclosed
US-20170152288-A1 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY NOVALIX DEUTSCHLAND GMBH (DE) 2017-06-01 US disclosed
US-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2016-07-07 US disclosed
EP-2935269-A1 THERAPEUTICALLY ACTIVE PYRAZOLO-PYRIMIDINE DERIVATIVES UCB Biopharma SPRL (BE) 2015-10-28 EP disclosed
EP-2601208-B1 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2015-02-11 EP disclosed
WO-2014096423-A1 THERAPEUTICALLY ACTIVE PYRAZOLO-PYRIMIDINE DERIVATIVES UCB PHARMA S.A. (BE) 2014-06-26 WO disclosed
EP-2690495-A1 Lithographic printing plate precursor and plate making method thereof Fujifilm Corporation (JP) 2014-01-29 EP disclosed
EP-2601208-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY Graffinity Pharmaceuticals GmbH (DE) 2013-06-12 EP disclosed
US-20130131321-A1 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2013-05-23 US disclosed
WO-2012017021-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-09 WO disclosed
US-4132436-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1979-01-02 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-20160194329-A1 Therapeutically Active Pyrazolo-Pyrimidine Derivatives HAVCR2, TPMT, NFATC1 SLC9A1 3902/4885GRM2 2805/4885CYP1A2 2465/4885
US-20170152288-A1 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY FCGR1A, FCGR2A, FCGR3B SLC9A1 4497/4885GRM2 1967/4885CYP1A2 4537/4885
US-20130131321-A1 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY FCGR1A, FCGR2A, FCER2 SLC9A1 2326/4885GRM2 134/4885CYP1A2 1546/4885

“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.