SCHEMBL9326469

SCHEMBL9326469

CCCn1cncc1C1(CC)Cc2ccccc2C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.47
ADRA2B P18089 3/20 0.47
ADRA2C P18825 3/20 0.47
ADRA1B P35368 2/20 0.47
QPCT Q16769 1/20 0.34
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 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
SCHEMBL9325531 0.88 ADRA2A (0.49) ADRA2AADRA2BADRA2CADRA1BQPCT
SCHEMBL9325913 0.84 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1BQPCT
SCHEMBL31034847 0.84 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1BQPCT
SCHEMBL9324769 0.83 CYP11B2 (0.46) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL9326644 0.80 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1BQPCT
SCHEMBL3904093 0.74 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL9324722 0.69 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1BQPCT
SCHEMBL9325910 0.66 ADRA2A (0.43) ADRA2AADRA2BADRA2CADRA1BMEN1
SCHEMBL1502091 0.64 CYP11B1 (0.62) ALDH1A1
Atipamezole SCHEMBL304971 0.64 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372954-B1 Substituted imidazole derivatives and their preparation and use ORION YHTYMAE OY (FI) 1994-03-09 EP claimed
US-5292887-A Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents FARMOS-YHTYMA OY (FI) 1994-03-08 US claimed
CN-1023219-C Substituted imidazole derivatives and their preparation and use FARMOS OY (FI) 1993-12-22 CN disclosed
CN-1043128-A The imdazole derivatives and the preparation thereof that replace FARMOS OY (FI) 1990-06-20 CN disclosed