SCHEMBL25636740

SCHEMBL25636740

CCCN1CCC(OCCN)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.44
HRH3 Q9Y5N1 2/20 0.41
DRD2 P14416 5/20 0.39
GNAI3 P08754 2/20 0.37
GNAO1 P09471 2/20 0.37
GNAI1 P63096 2/20 0.37
CARM1 Q86X55 3/20 0.36
PRMT6 Q96LA8 3/20 0.36
PABPC1 P11940 1/20 0.36
TMEM97 Q5BJF2 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
PRMT8 Q9NR22 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
SCHEMBL24607305 0.86 NPC1 (0.48) NPC1HRH3DRD2GNAI3GNAO1
SCHEMBL24661412 0.85 SMN1; SMN2 (0.41) NPC1HRH3CARM1PRMT6TMEM97
SCHEMBL25972078 0.83 NPC1 (0.46) NPC1HRH3DRD2GNAI3GNAO1
SCHEMBL20234299 0.81 NPC1 (0.41) NPC1HRH3CARM1PRMT6TMEM97
SCHEMBL21214843 0.81 NPC1 (0.41) NPC1HRH3DRD2CARM1PRMT6
SCHEMBL23970916 0.80 NCF1 (0.46) NPC1HRH3
SCHEMBL22477411 0.80 HRH3 (0.45) NPC1HRH3DRD2GNAI3GNAO1
SCHEMBL27013893 0.80 NPC1 (0.43) NPC1HRH3DRD2CARM1PRMT6
SCHEMBL22856368 0.79 NPC1 (0.42) NPC1HRH3DRD2CARM1PRMT6
SCHEMBL18551309 0.79 CARM1 (0.50) HRH3CARM1PRMT6TMEM97SIGMAR1

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-2023097251-A1 OLIGONUCLEOTIDE-CONTAINING TRANSCRIPTION FACTOR TARGETING CHIMERAS YALE UNIVERSITY (US) 2023-06-01 WO disclosed