SCHEMBL30801153

SCHEMBL30801153

COc1ccccc1C1CCC(c2ccccc2OC)NC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.57
TACR1 P25103 2/20 0.46
DRD2 P14416 1/20 0.46
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
USP2 O75604 1/20 0.41
MAP1LC3B Q9GZQ8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL23348172 0.85 HTR2A (0.56) HTR2CMEN1KMT2A
SCHEMBL26472925 0.85 HTR2A (0.56) HTR2CMEN1KMT2A
SCHEMBL25722433 0.85 HTR2A (0.56) HTR2CMEN1KMT2A
SCHEMBL23348066 0.85 HTR2A (0.56) HTR2CMEN1KMT2A
SCHEMBL25722435 0.85 HTR2A (0.56) HTR2CMEN1KMT2A
SCHEMBL24367125 0.84 HTR2C (0.49) HTR2CTACR1DRD2MEN1KMT2A
SCHEMBL1515163 0.80 HTR2C (0.75) HTR2CDRD2MEN1KMT2AADRA1D
SCHEMBL5017875 0.79 CHRNB2 (0.47) HTR2C
SCHEMBL21912179 0.79 CHRNB2 (0.47) HTR2C
SCHEMBL23323077 0.77 MEN1 (0.65) HTR2CTACR1MEN1KMT2A

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-114761083-B 5-HT for treating depression 2A Agonists 罗福拉公司 2024-02-13 CN disclosed