SCHEMBL23639251

SCHEMBL23639251

CC1CCN(c2ccc(C=N)c(NCC=O)n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 5/20 0.38
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR1D P28221 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TSHR P16473 3/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL23055252 0.79 KMT2A (0.38) OGAKCNH2HRH3MEN1KMT2A
SCHEMBL24784431 0.63 MAPT (0.40) OGAKCNH2HRH3ADRA2BADRA2C
SCHEMBL27914111 0.63 ALDH1A1 (0.44) OGAALDH1A1MEN1KMT2ALMNA
SCHEMBL23432729 0.62 HRH3 (0.42) HRH3HTR2CALDH1A1MEN1KMT2A
SCHEMBL17481378 0.61 HRH4 (0.40) OGAKCNH2HRH3MEN1KMT2A
SCHEMBL23602749 0.61 HRH3 (0.55) KCNH2HRH3ALDH1A1MEN1KMT2A
SCHEMBL12302240 0.60 ALDH1A1 (0.56) KCNH2HRH3ALDH1A1MEN1KMT2A
SCHEMBL17481374 0.59 MAPT (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL6628400 0.59 MAPT (0.45) OGAHRH3ALDH1A1MEN1KMT2A
SCHEMBL25188971 0.59 MEN1 (0.47) OGAKCNH2HRH3ALDH1A1MEN1

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-2021141041-A1 THERAPEUTIC AGENT FOR TAUOPATHIES 大日本住友製薬株式会社 2021-07-15 WO disclosed