SCHEMBL27355467

SCHEMBL27355467

[O-][S+](Cc1ccccc1F)c1ncc[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
TAAR1 Q96RJ0 4/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
POLB P06746 2/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
TP53 P04637 1/20 0.32
BACE1 P56817 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
HTR1A P08908 1/20 0.32
AOC3 Q16853 1/20 0.32

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
SCHEMBL9012347 0.82 ATP4A (0.33) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL27354244 0.80 MC4R (0.35) ADRA2AADRA2BADRA2CNPC1RAB9A
SCHEMBL9012162 0.78 TAAR1 (0.35) TAAR1ADRA2AADRA2BADRA2CHTR1A
SCHEMBL27342985 0.78 ADRA2A (0.40) TAAR1ADRA2ASMN1; SMN2ALDH1A1TP53
SCHEMBL9012337 0.78 TAAR1 (0.35) TAAR1ADRA2AADRA2BADRA2CPOLB
SCHEMBL6527231 0.78 TAAR1 (0.47) TAAR1ADRA2ASMN1; SMN2HSD17B10MTOR
SCHEMBL27270255 0.77 ADRA2A (0.31) ADRA2AADRA2BADRA2CKDM4E
SCHEMBL27357187 0.77 TAAR1 (0.46) TAAR1ADRA2AADRA2CPOLBNPC1
SCHEMBL9011902 0.76 AR (0.36) TAAR1ADRA2AADRA2BADRA2CPOLB
SCHEMBL8517908 0.76 ADRA2A (0.33) TAAR1ADRA2AADRA2BADRA2CHTR1A

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-1058594-A Imidazo [4,5-C] pyridines osteoporosis agent AMERICAN HOME PROD (US) 1992-02-12 CN claimed
CN-1058594-A Imidazo [4,5-C] pyridines osteoporosis agent AMERICAN HOME PROD (US) 1992-02-12 CN disclosed