SCHEMBL28162183

SCHEMBL28162183

CN(C)C1c2ccccc2CC1N

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 13/20 0.44
HTR2C P28335 12/20 0.44
HTR2B P41595 12/20 0.44
HRH3 Q9Y5N1 12/20 0.44
SIGMAR1 Q99720 2/20 0.44
KDM1A O60341 4/20 0.43
KAT2B Q92831 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
SCHEMBL19200494 1.00 HTR2A (0.44) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL17571679 1.00 HTR2A (0.44) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL17571730 1.00 HTR2A (0.44) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL20678607 0.81 SIGMAR1 (0.39) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL5907844 0.81 SIGMAR1 (0.39) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL1941901 0.80 KDM1A (0.37) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL17571758 0.78 HTR2A (0.46) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL18161259 0.78 HTR2A (0.46) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL17835702 0.77 HTR2A (0.44) HTR2AHTR2CHTR2BHRH3SIGMAR1
SCHEMBL17559139 0.77 HTR2A (0.44) HTR2AHTR2CHTR2BHRH3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107074824-B Phthalazine derivatives of formula (I) as PCAF and GCN5 inhibitors for the treatment of cancer 基因泰克公司 2021-01-08 CN disclosed
CN-107074824-A Phthalazine derivatives of formula (I) as PCAF and GCN5 inhibitors for the treatment of cancer 基因泰克公司 2017-08-18 CN disclosed