SCHEMBL9325910

SCHEMBL9325910

CCC1(c2cn(C)cn2)Cc2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.43
ADRA2B P18089 2/20 0.43
ADRA2C P18825 2/20 0.43
ADRA1B P35368 2/20 0.43
TSHR P16473 3/20 0.35
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2C9 P11712 3/20 0.31
CYP2C19 P33261 3/20 0.31
MTOR P42345 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SLC6A9 P48067 2/20 0.30
CYP2E1 P05181 1/20 0.30
CYP2A6 P11509 1/20 0.30
CYP2B6 P20813 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL9325885 0.88 ADRA2A (0.35) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL9324682 0.86 TSHR (0.35) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL9324722 0.84 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1BMEN1
SCHEMBL8766326 0.84 TSHR (0.33) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL9325735 0.83 ADRA2A (0.42) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL9325930 0.79 HPGDS (0.40) ADRA2AADRA2BADRA2CADRA1BCYP2C9
SCHEMBL31034854 0.76 ADRA2A (0.37) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL31034887 0.76 POLB (0.41) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL31034870 0.76 FAAH (0.39) ADRA2AADRA2BADRA2CADRA1BTSHR
SCHEMBL31034900 0.74 FAAH (0.43) ADRA2AADRA2BADRA2CADRA1BHRH3

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 8 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
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP claimed
JP-2202874-A None JP disclosed
EP-0372954-B1 Substituted imidazole derivatives and their preparation and use ORION YHTYMAE OY (FI) 1994-03-09 EP disclosed
US-5292887-A Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents FARMOS-YHTYMA OY (FI) 1994-03-08 US disclosed
JP-H02202874-A SUBSTITUTED IMIDAZOLE, PREPARATION THEROF AND DRUG COMPOSITION CONTAINING SAME AS EFFECTIVE COMPONENT FARMOS YHTYMAE OY 1990-08-10 JP disclosed
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP disclosed