SCHEMBL31433127

SCHEMBL31433127

N#Cc1ccc(-c2ccc(OCCCCn3c4ccccc4c4ccccc43)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.52
HRH2 P25021 15/20 0.52
HRH1 P35367 15/20 0.52
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
MMP3 P08254 1/20 0.47
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL31433128 0.86 PSEN1 (0.52) HRH3PSEN1PSEN2APH1BNCSTN
SCHEMBL31433133 0.86 PSEN1 (0.52) HRH3PSEN1PSEN2APH1BNCSTN
SCHEMBL31433130 0.86 PSEN1 (0.52) HRH3PSEN1PSEN2APH1BNCSTN
SCHEMBL29102214 0.80 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL22457625 0.80 PTGER4 (0.42) HRH3HRH2HRH1PSEN1PSEN2
SCHEMBL26602050 0.79 MMP3 (0.66) HRH3HRH2HRH1MMP3HTT
SCHEMBL5152501 0.78 FABP4 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18079151 0.77 HDAC1 (0.67) HRH3HRH2HRH1MMP3HTT
SCHEMBL16841044 0.77 HDAC1 (0.67) HRH3HRH2HRH1MMP3HTT
SCHEMBL29444063 0.77 HDAC1 (0.67) HRH3HRH2HRH1MMP3HTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119638613-A Novel room temperature phosphorescent light-emitting body with mechanochromatic characteristic and preparation method thereof 天津大学 2025-03-18 CN claimed
CN-119638613-B Novel room temperature phosphorescent light-emitting body with mechanochromatic characteristic and preparation method thereof 天津大学 2025-09-23 CN disclosed
CN-119638613-A Novel room temperature phosphorescent light-emitting body with mechanochromatic characteristic and preparation method thereof 天津大学 2025-03-18 CN disclosed
CN-119638613-A Novel room temperature phosphorescent light-emitting body with mechanochromatic characteristic and preparation method thereof 天津大学 2025-03-18 CN disclosed