SCHEMBL9326720

SCHEMBL9326720

CCC1(c2cn(C)cn2)Cc2ccccc2C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.40
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
KMT2A Q03164 2/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
PRNP P04156 2/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9326834 0.90 NPSR1 (0.39) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL8765988 0.86 NPSR1 (0.39) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9324700 0.79 TP53 (0.39) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL8610413 0.77 NPSR1 (0.43) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9324661 0.76 NPSR1 (0.40) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9324708 0.76 NPSR1 (0.38) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9325910 0.75 ADRA2A (0.43) NPSR1LMNAALDH1A1ADRA1BKMT2A
SCHEMBL9327660 0.72 NPSR1 (0.38) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9327773 0.71 NPSR1 (0.38) NPSR1HTTLMNAL3MBTL1ALDH1A1
SCHEMBL9325885 0.70 ADRA2A (0.35) LMNAALDH1A1ADRA1BKMT2ATSHR

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 6 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
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
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP disclosed