SCHEMBL8967976

SCHEMBL8967976

COc1ccc(NCC23CCCN2CCC3)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCN4 Q9Y3Q4 4/20 0.42
HCN1 O60741 4/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 3/20 0.40
FTO Q9C0B1 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CDC25B P30305 2/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 2/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL8555066 0.75 CTSB (0.45) MAPTTDP1MEN1KMT2ARAB9A
SCHEMBL8967617 0.73 TUBB3 (0.38) HCN4HCN1TP53MAPTFTO
SCHEMBL8553639 0.70 TDP1 (0.44) MAPTTDP1L3MBTL1MEN1KMT2A
SCHEMBL8968027 0.70 TUBB3 (0.36) HCN4HCN1TP53MAPTFTO
SCHEMBL8554926 0.68 HSP90AA1 (0.42) TP53MAPTMEN1KMT2ACRHBP
SCHEMBL20653820 0.67 KMT2A (0.46) MAPTFTOMEN1KMT2AGAA
SCHEMBL18458726 0.67 ACHE (0.59) TP53L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL8555791 0.66 MAPT (0.47) MAPTTDP1L3MBTL1MEN1KMT2A
SCHEMBL8852163 0.65 CDC25B (0.54) MAPTMEN1KMT2ACDC25B
SCHEMBL809077 0.65 CDC25B (0.58) MAPTMEN1KMT2ACDC25BKDM4E

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-0647642-A1 1-Azabicyclo(3.3.0)octane derivatives and their use SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1995-04-12 EP claimed
US-5530138-A A PYRROLIZINE DERIVATIVE; EFFECTIVE IN THE TREATMENT OF SENILE DEMENTIA SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1996-06-25 US disclosed
EP-0647642-A1 1-Azabicyclo(3.3.0)octane derivatives and their use SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1995-04-12 EP disclosed