SCHEMBL30366227

SCHEMBL30366227

C[C@@H]1CNCC[C@H]1c1ccc(Cl)cn1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.39
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37

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
SCHEMBL19375935 0.78 HTR3A (0.56) HTR3A
Hydrochloric Acid SCHEMBL21385247 0.76 P2RY14 (0.35) HTR2AHTR2CHTR2B
SCHEMBL18633599 0.76 HTR3A (0.58) HTR3A
SCHEMBL23073892 0.74
SCHEMBL2885151 0.74 HTR3A (0.46) HTR3A
SCHEMBL30899636 0.74 CHRNB2 (0.40) HTR2CHTR2B
Hydrochloric Acid SCHEMBL941521 0.72 NPC1 (0.47) HTR3A
SCHEMBL23062573 0.71 MAPT (0.58)
Hydrochloric Acid SCHEMBL4892700 0.70 HTR2C (0.47) HTR3AHTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL4892694 0.70 HTR2C (0.47) HTR3AHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4405051-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2024-07-31 EP disclosed
CN-118076604-A Pyrazolo [3,4-b ] pyridine compounds for the treatment of autoimmune diseases 豪夫迈·罗氏有限公司 2024-05-24 CN disclosed
WO-2023046806-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2023-03-30 WO disclosed