SCHEMBL31536293

SCHEMBL31536293

c1ccc2c(c1)CCC(c1c[nH]c3ccccc13)O2

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.47
ADRB2 P07550 1/20 0.47
MGAM O43451 2/20 0.46
GAA P10253 2/20 0.46
SI P14410 2/20 0.46
MGAM2 Q2M2H8 2/20 0.46
AR P10275 1/20 0.46
HTR2A P28223 3/20 0.44
HTR2B P41595 3/20 0.44
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.42
SLC6A4 P31645 1/20 0.41
IDO1 P14902 3/20 0.40
CYP2D6 P10635 1/20 0.40
LMNA P02545 1/20 0.40
BRD4 O60885 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
CREBBP Q92793 1/20 0.39

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
SCHEMBL31536116 0.75 ADORA3 (0.57) HTR2CGAAARHTR2AHTR2B
SCHEMBL9027059 0.73 HTR2C (0.56) HTR2CADRB2MGAMGAASI
SCHEMBL30127594 0.73 HTR2C (0.51) HTR2CADRB2MGAMGAASI
SCHEMBL4057053 0.73 HTR2C (0.51) HTR2CADRB2MGAMGAASI
SCHEMBL13255020 0.71 HTR2C (0.41) HTR2CADRB2MGAMGAASI
SCHEMBL6912722 0.71 CA2 (0.41) ARKDM4EIDO1CREBBP
SCHEMBL1985653 0.71 AR (0.55) AR
SCHEMBL15016568 0.71 CA2 (0.41)
Flavane SCHEMBL123287 0.70 ESR1 (0.51) ARKDM4E
Flavane SCHEMBL14394530 0.70 ESR1 (0.51) ARKDM4E

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
CN-119977949-A Chromone bisindole derivative and preparation method and application thereof 重庆文理学院 2025-05-13 CN disclosed