SCHEMBL30946643

SCHEMBL30946643

Oc1ccc2c(n1)CCCC2

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 5/20 0.52
ADRA2B P18089 5/20 0.52
ADRA2C P18825 5/20 0.52
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
CDK5 Q00535 2/20 0.36
CDK5R1 Q15078 2/20 0.36
SORT1 Q99523 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PRNP P04156 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TSHR P16473 1/20 0.35
BCL2L1 Q07817 1/20 0.34
BAD Q92934 1/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
GRM5 P41594 1/20 0.34

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
SCHEMBL1024155 1.00 ADRA2A (0.52) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL13944881 0.95 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL31184295 0.95 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL4203505 0.77 ADCY6 (0.43) HTR2AHTR2C
SCHEMBL23561744 0.77 PNMT (0.41) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL29648993 0.76 ADRA2A (0.50) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL1020718 0.73 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL4599116 0.73 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL13068957 0.73 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL31494678 0.73 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C

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-112312909-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2024-07-02 CN disclosed