SCHEMBL9324769

SCHEMBL9324769

CCC1(c2cncn2Cc2ccccc2)Cc2ccccc2C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 9/20 0.46
CYP11B1 P15538 8/20 0.46
IDO1 P14902 2/20 0.46
ADRA2A P08913 2/20 0.45
ADRA2B P18089 2/20 0.45
ADRA2C P18825 2/20 0.45
ADRA1B P35368 2/20 0.45
HPGDS O60760 1/20 0.40
P2RX7 Q99572 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
CYP19A1 P11511 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35

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
SCHEMBL3904093 0.89 ADRA2A (0.50) CYP11B2CYP11B1IDO1ADRA2AADRA2B
SCHEMBL9325531 0.86 ADRA2A (0.49) CYP11B2CYP11B1IDO1ADRA2AADRA2B
SCHEMBL9326469 0.83 ADRA2A (0.47) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL31034847 0.79 ADRA2A (0.50) IDO1ADRA2AADRA2BADRA2CADRA1B
SCHEMBL9325913 0.79 ADRA2A (0.50) IDO1ADRA2AADRA2BADRA2CADRA1B
SCHEMBL9326644 0.75 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL9325930 0.70 HPGDS (0.40) CYP11B2CYP11B1ADRA2AADRA2BADRA2C
SCHEMBL27984850 0.68 CYP11B1 (0.62) CYP11B2CYP11B1IDO1HPGDSP2RX7
SCHEMBL6496747 0.68 CYP11B1 (0.63) CYP11B2CYP11B1IDO1HPGDSP2RX7
SCHEMBL9413343 0.66 CYP11B1 (0.62) CYP11B2CYP11B1IDO1HPGDSP2RX7

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 3 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