SCHEMBL23747740

SCHEMBL23747740

CN1CCN(Cc2ccc(NCNCc3ccc(Cl)cc3)cc2)C(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
DRD3 P35462 1/20 0.39
KCNH2 Q12809 1/20 0.39
HPGD P15428 1/20 0.38
GAA P10253 2/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
ERCC1 P07992 1/20 0.36
ERCC4 Q92889 1/20 0.36
P2RX7 Q99572 1/20 0.36
HTR6 P50406 1/20 0.35
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 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
SCHEMBL26101687 0.80 RAB9A (0.57) MEN1KMT2AHPGDRAB9AERCC1
SCHEMBL23747697 0.79 L3MBTL1 (0.45) L3MBTL1MEN1KMT2AHPGDGAA
SCHEMBL31029198 0.74 GAA (0.45) MEN1KMT2AGAACYP1A2CYP2C9
SCHEMBL15858059 0.72 LMNA (0.51) MEN1KMT2ALMNAALDH1A1HTT
SCHEMBL26548227 0.71 LMNA (0.56) L3MBTL1KMT2ADRD3KCNH2GAA
SCHEMBL15858005 0.71 ALDH1A1 (0.53) L3MBTL1MEN1KMT2ARAB9AALDH1A1
SCHEMBL12361201 0.71 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ADRD3KCNH2
SCHEMBL23747349 0.71 RAB9A (0.48) MEN1KMT2AHPGDCYP1A2CYP2C19
SCHEMBL23747348 0.70 CYP1A2 (0.44) MEN1KMT2AHPGDCYP1A2CYP2C19
SCHEMBL23747464 0.70 RAB9A (0.56) MEN1KMT2ARAB9AALDH1A1

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-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 WO disclosed