SCHEMBL24722902

SCHEMBL24722902

C[C@@H](N(C)C)N1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
KCNA5 P22460 1/20 0.33
ALDH1A1 P00352 5/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PKM P14618 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MEN1 O00255 1/20 0.32
MGLL Q99685 2/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
PIK3CD O00329 1/20 0.30
USP2 O75604 1/20 0.30

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
SCHEMBL809036 1.00 MAPT (0.36) MAPTKCNA5ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6367938 0.81
SCHEMBL7396087 0.76 MAPT (0.35) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL109412 0.74 FDPS (0.32) KCNA5SMN1; SMN2CYP3A4CYP2C19
SCHEMBL13351477 0.73 USP2 (0.38) MAPTKCNA5ALDH1A1KMT2ASMN1; SMN2
SCHEMBL13319168 0.73 SLC6A2 (0.34) MAPTALDH1A1KMT2ALMNAHPGD
SCHEMBL13319167 0.73 MAPT (0.35) MAPTKCNA5ALDH1A1KMT2ALMNA
SCHEMBL7977214 0.73 MAPT (0.41) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL21954031 0.73 HRH3 (0.38) MAPTKCNA5ALDH1A1KMT2ASMN1; SMN2
SCHEMBL57306 0.73

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-2022166920-A1 PYRROLOPYRIDAZINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 杭州中美华东制药有限公司 2022-08-11 WO disclosed