SCHEMBL24980301

SCHEMBL24980301

c1ccc(CNCCN2c3ccccc3Sc3ccccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.57
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
LMNA P02545 1/20 0.51
SIGMAR1 Q99720 2/20 0.50
SNCA P37840 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
BCHE P06276 1/20 0.50
DPP7 Q9UHL4 1/20 0.49
PIM1 P11309 1/20 0.49
MAPT P10636 1/20 0.48
PPARG P37231 1/20 0.47

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
SCHEMBL21467524 0.80 LMNA (0.60) KDM1AMEN1KMT2ALMNASIGMAR1
SCHEMBL6866025 0.79 KDM1A (0.55) KDM1ALMNASIGMAR1PIM1MAPT
SCHEMBL3696468 0.78 SIGMAR1 (0.63) KDM1AMEN1KMT2ALMNASIGMAR1
SCHEMBL4231534 0.77 SLC6A2 (0.54) MEN1KMT2ALMNATDP1DPP7
SCHEMBL6749822 0.76 KDM1A (0.49) KDM1ALMNASIGMAR1PIM1MAPT
SCHEMBL15775165 0.74 MEN1 (0.55) KDM1AMEN1KMT2ALMNASIGMAR1
SCHEMBL3692906 0.73 HDAC6 (0.59) KDM1AMEN1KMT2ALMNASIGMAR1
SCHEMBL30307018 0.73 HDAC6 (0.59) KDM1AMEN1KMT2ALMNASIGMAR1
SCHEMBL6866031 0.73 SIGMAR1 (0.52) KDM1ALMNASIGMAR1PIM1MAPT
SCHEMBL208025 0.71 PIM1 (0.79) KDM1AMEN1KMT2ALMNASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023007181-A1 PHENOTHIAZINE ANTIPSYCHOTICS FOR USE IN THE TREATMENT OF GLIOBLASTOMA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2023-02-02 WO disclosed