SCHEMBL30462012

SCHEMBL30462012

CN1CCN(c2cnc(Cl)nc2Cl)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
POLB P06746 2/20 0.44
HRH4 Q9H3N8 6/20 0.42
HTR3A P46098 5/20 0.42
HTR3B O95264 2/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
HTR3E A5X5Y0 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
RAD52 P43351 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL17225009 1.00 SMN1; SMN2 (0.57) SMN1; SMN2POLBHRH4HTR3AHTR3B
SCHEMBL17269955 0.83 POLB (0.40) SMN1; SMN2POLBKDM4EMAPT
SCHEMBL24393197 0.81 ALDH1A1 (0.41) SMN1; SMN2POLBKDM4E
SCHEMBL3767624 0.79 MAPK1 (0.42) SMN1; SMN2KDM4EMAPT
SCHEMBL1491746 0.75 SMN1; SMN2 (0.71) SMN1; SMN2HRH4HTR3AHTR3BHTR3E
SCHEMBL20810660 0.74 POLB (0.51) SMN1; SMN2POLBMAPT
SCHEMBL28514042 0.73 SMN1; SMN2 (0.54) SMN1; SMN2POLBHRH4HTR3AHTR3B
SCHEMBL20182744 0.72 SMN1; SMN2 (1.00) SMN1; SMN2HRH4HTR3AHTR3BKDM4E
SCHEMBL17225000 0.72 SMN1; SMN2 (0.43) SMN1; SMN2POLBHRH4HTR3AHTR3B
SCHEMBL17225022 0.71 SMN1; SMN2 (0.34) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025007777-A1 PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2025-01-09 WO disclosed
CN-118660872-A Pyrimidine compound, preparation method and medical application thereof 江苏亚虹医药科技股份有限公司 2024-09-17 CN disclosed
CN-116685583-A Pyrimidine compounds, compositions and pharmaceutical uses thereof 缆图药品公司 2023-09-01 CN disclosed
CN-116496252-A Pyrimidine compound, preparation method and medical application thereof 江苏亚虹医药科技股份有限公司 2023-07-28 CN disclosed