SCHEMBL11519907

SCHEMBL11519907

[Li]Cc1ccc2c(n1)CCCC2

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 6/20 0.43
ADRA2B P18089 6/20 0.43
ADRA2C P18825 6/20 0.43
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.36
CDK5 Q00535 2/20 0.33
CDK5R1 Q15078 2/20 0.33
PRNP P04156 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CHRM4 P08173 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
GRM5 P41594 1/20 0.32
TSHR P16473 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL23425843 0.82 ADRA2A (0.44) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL9790156 0.80 ADRA2A (0.43) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL4206586 0.80 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL5335231 0.80 CCR1 (0.43) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL8249471 0.80 ADRA2A (0.47) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL6859088 0.80 ADRA2A (0.43) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL21107868 0.78 ADRA2A (0.42) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL12942913 0.78 ADRA2A (0.42) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL13977967 0.78 ADRA2A (0.41) ADRA2AADRA2BADRA2CHTR2AHTR2C
SCHEMBL25060993 0.77 ADRA2A (0.41) 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
US-4160094-A Tetrahydroquinoline derivatives JOHN WYETH & BROTHER LIMITED (GB) 1979-07-03 US disclosed