SCHEMBL30499299

SCHEMBL30499299

CN1CCN(CCOc2ccc3c(Cl)ccnc3c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SIGMAR1 Q99720 3/20 0.53
TGFBR1 P36897 2/20 0.51
MET P08581 1/20 0.48
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CXCR1 P25024 1/20 0.47
NPC1 O15118 1/20 0.46
DRD3 P35462 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
LTA4H P09960 1/20 0.46
GRM4 Q14833 2/20 0.45
AIMP2 Q13155 1/20 0.45
PRKDC P78527 1/20 0.45

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
SCHEMBL25131312 1.00 KDM4E (0.56) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL27006796 0.94 HRH3 (0.54) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL27006787 0.91 ALDH1A1 (0.51) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL14495853 0.86 KDM4E (0.64) KDM4EALDH1A1SIGMAR1TGFBR1MET
SCHEMBL30499279 0.86 KDM4E (0.64) KDM4EALDH1A1SIGMAR1TGFBR1MET
SCHEMBL27006913 0.86 KDM4E (0.50) KDM4EALDH1A1LMNAMAPK1HTT
SCHEMBL30425758 0.86 LMNA (0.43) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL27006819 0.85 TGFBR1 (0.51) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL31103176 0.85 TGFBR1 (0.51) KDM4EALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL27006997 0.85 GRM4 (0.52) KDM4EALDH1A1MEN1KMT2ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201915-A Pyridazinylamino derivatives as ALK5 inhibitors 奇斯药制品公司 2024-06-14 CN disclosed
CN-116096719-A Pyridazinylamino derivatives as ALK5 inhibitors 奇斯药制品公司 2023-05-09 CN disclosed