SCHEMBL27033804

SCHEMBL27033804

COCCOc1nc(Cl)cc(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRA P19793 13/20 0.38
RXRB P28702 12/20 0.38
RXRG P48443 9/20 0.38
PLAU P00749 1/20 0.37
TSHR P16473 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TLR7 Q9NYK1 3/20 0.36
NUDT1 P36639 2/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL17581149 0.87 RIPK2 (0.38) RXRARXRBRXRGPLAUTLR7
SCHEMBL31543572 0.82 RXRA (0.36) RXRARXRBRXRGPLAUTLR7
SCHEMBL1914478 0.81 NQO2 (0.39) RXRARXRBRXRGPPARGPPARD
SCHEMBL28803013 0.81 RXRA (0.39) RXRARXRBRXRGL3MBTL1PPARG
SCHEMBL28803019 0.79 RXRA (0.43) RXRARXRBRXRGPPARGPPARD
SCHEMBL25659408 0.79 TSHR (0.41) TSHRPOLBL3MBTL1TLR7NUDT1
SCHEMBL25136401 0.79 BCHE (0.38) PLAUTSHRPOLBL3MBTL1
SCHEMBL6223037 0.79 TSHR (0.38) RXRAPLAUTSHRTLR7NUDT1
SCHEMBL917646 0.78 TLR7 (0.35) PLAUTSHRPOLBL3MBTL1TLR7
SCHEMBL8960380 0.78 TSHR (0.36) PLAUTSHRPOLBL3MBTL1TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240382482-A1 PLASMA KALLIKREIN INHIBITORS TAKEDA PHARMACEUTICALS CO (JP) 2024-11-21 US disclosed
WO-2024125451-A1 PIPERINDIN-ONES DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-20 WO disclosed
WO-2024125464-A1 TETRAHYDROISOQUINOLIN-ONE DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-20 WO disclosed
CN-117940433-A Quinoline furan derivative and application thereof 瑞石生物医药有限公司 2024-04-26 CN disclosed
EP-4308228-A1 PLASMA KALLIKREIN INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2024-01-24 EP disclosed
CN-117396474-A Plasma kallikrein inhibitors 武田药品工业株式会社 2024-01-12 CN disclosed
WO-2023025298-A1 QUINOLINOFURAN DERIVATIVE AND USE THEREOF 瑞石生物医药有限公司 2023-03-02 WO disclosed
WO-2022197756-A1 PLASMA KALLIKREIN INHIBITORS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 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 (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-20240382482-A1 PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 RXRA 4447/4885RXRB 4414/4885RXRG 4126/4885

“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.