SCHEMBL28348254

SCHEMBL28348254

CC1c2ccccc2C(C)C1Br

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GPR3 P46089 2/20 0.33
USP2 O75604 1/20 0.32
OPRM1 P35372 1/20 0.32
AADAT Q8N5Z0 1/20 0.31
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL1574024 0.75 GPR3 (0.36) MEN1KMT2AGPR3USP2AADAT
SCHEMBL12657209 0.74
SCHEMBL3236677 0.71 AADAT (0.39) MEN1KMT2AGPR3AADATNOS3
SCHEMBL3236671 0.71 AADAT (0.39) MEN1KMT2AGPR3AADATNOS3
SCHEMBL3236685 0.71 AADAT (0.39) MEN1KMT2AGPR3AADATNOS3
SCHEMBL9464683 0.69 MEN1 (0.32) MEN1KMT2AGPR3HTR2A
SCHEMBL18080870 0.69 MAOA (0.37) MEN1KMT2AGPR3USP2AADAT
SCHEMBL12238736 0.69 GPR3 (0.32) GPR3OPRM1
SCHEMBL8678894 0.67 MEN1 (0.35) MEN1KMT2AGPR3HTR2A
SCHEMBL18887229 0.67

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-110650965-B Dihydrocarbyl-silyl-bridged-1,3 disubstituted-2-indenyl metallocene complexes for olefin polymerization SABIC环球技术有限责任公司 2022-10-04 CN disclosed
CN-110650965-A Dihydrocarbyl-silyl-bridged-1, 3 disubstituted-2-indenyl metallocene complexes for olefin polymerization SABIC环球技术有限责任公司 2020-01-03 CN disclosed