SCHEMBL18745971

SCHEMBL18745971

CNc1ccc2c(cnn2-c2ccc(NC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.47
MAPT P10636 9/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
TNIK Q9UKE5 1/20 0.45
RAB9A P51151 8/20 0.45
NPC1 O15118 7/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 5/20 0.44
MEN1 O00255 3/20 0.44
LMNA P02545 3/20 0.44
MCL1 Q07820 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MCHR1 Q99705 1/20 0.43
ATM Q13315 1/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 3/20 0.42

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
SCHEMBL1663344 0.90 MAOB (0.56) MAOBMAPTSMN1; SMN2TNIKRAB9A
SCHEMBL1666463 0.90 MAPT (0.52) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1664927 0.89 TNIK (0.44) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL8771269 0.89 MAOB (0.47) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1665026 0.89 MAOB (0.43) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1665595 0.89 ABL1 (0.48) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL6126511 0.89 MAOB (0.46) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1664559 0.89 ABL1 (0.48) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1664478 0.89 MAOB (0.46) MAOBMAPTSMN1; SMN2KDM4EHPGD
SCHEMBL1663848 0.89 TNIK (0.47) MAOBMAPTSMN1; SMN2KDM4EHPGD

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
US-9622991-B2 Hematopoietic growth factor mimetic small molecule compounds and their uses LIGAND PHARMACEUTICALS INC. (US) 2017-04-18 US disclosed