SCHEMBL30933780

SCHEMBL30933780

OCCCOc1ccc(Cl)cc1CNCC1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SLC6A4 P31645 1/20 0.40
F10 P00742 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CHRM1 P11229 4/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
STAT3 P40763 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SLC2A1 P11166 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38

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
Hydrochloric Acid SCHEMBL30933665 0.99 CYP1A2 (0.47) PRMT5WDR77CYP1A2CYP2D6LMNA
Hydrochloric Acid SCHEMBL30933749 0.93 CYP1A2 (0.48) PRMT5WDR77CYP1A2CYP2D6SLC6A4
SCHEMBL30933772 0.88 MAPT (0.52) PRMT5WDR77CYP1A2CYP2D6KDM4E
Hydrochloric Acid SCHEMBL30933684 0.88 KDM4E (0.44) PRMT5WDR77CYP1A2CYP2D6LMNA
SCHEMBL30933844 0.87 SLC6A4 (0.46) PRMT5WDR77CYP1A2CYP2D6KDM4E
Hydrochloric Acid SCHEMBL30933681 0.87 MAPT (0.51) PRMT5WDR77CYP1A2CYP2D6LMNA
Hydrochloric Acid SCHEMBL30933656 0.86 SLC6A4 (0.45) PRMT5WDR77CYP1A2CYP2D6KDM4E
SCHEMBL30933773 0.86 CYP2D6 (0.56) PRMT5WDR77CYP1A2CYP2D6LMNA
Hydrochloric Acid SCHEMBL30933803 0.85 CYP1A2 (0.58) PRMT5WDR77CYP1A2CYP2D6LMNA
Hydrochloric Acid SCHEMBL30933686 0.85 PRMT5 (0.47) PRMT5WDR77CYP1A2CYP2D6SLC6A4

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-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed