SCHEMBL25256071

SCHEMBL25256071

CCOC(=O)C(=O)Nc1cncnc1Cl

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 5/20 0.58
ALDH1A1 P00352 6/20 0.47
PKM P14618 1/20 0.47
GAA P10253 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 2/20 0.42
KMT2A Q03164 1/20 0.41
HPGD P15428 2/20 0.41
AKR1B1 P15121 1/20 0.41
PTPN1 P18031 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL30770361 1.00 GPR35 (0.58) GPR35ALDH1A1PKMGAAL3MBTL1
SCHEMBL18322240 0.86 GPR35 (0.43) GPR35ALDH1A1PKMGAANPC1
SCHEMBL30258095 0.85 ALDH1A1 (0.49) GPR35ALDH1A1L3MBTL1KMT2AHPGD
SCHEMBL23926998 0.85 ALDH1A1 (0.49) GPR35ALDH1A1L3MBTL1KMT2AHPGD
SCHEMBL28904450 0.84 GPR35 (0.41) GPR35ALDH1A1PKMGAAL3MBTL1
SCHEMBL2178702 0.77 GPR35 (0.58) GPR35ALDH1A1PKMGAAL3MBTL1
SCHEMBL16264456 0.77 GPR35 (0.67) GPR35ALDH1A1PKMGAAL3MBTL1
SCHEMBL23927035 0.75 HPGD (0.40) ALDH1A1PKMNPC1MAPTKMT2A
SCHEMBL30079569 0.75 HPGD (0.40) ALDH1A1PKMNPC1MAPTKMT2A
SCHEMBL16452808 0.75 PTK2 (0.43) ALDH1A1L3MBTL1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115427412-B Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-02-20 CN disclosed
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-31 US disclosed
EP-4190784-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2023-06-07 EP disclosed
EP-4190784-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2023-06-07 EP disclosed
CN-115427412-A Nitrogen-containing fused ring derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2022-12-02 CN 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 (1 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-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF NR5A1, WEE1, SHBG GPR35 2345/4885ALDH1A1 1091/4885PKM 750/4885

“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.