SCHEMBL12428417

SCHEMBL12428417

Bc1ccc(-c2cncc3ccccc23)nc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 14/20 0.51
▸ CYP11B1 P15538 11/20 0.51
▸ PRKCZ Q05513 1/20 0.46
▸ CNR1 P21554 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ CYP3A4 P08684 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2B6 P20813 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ KCNA5 P22460 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ CYP17A1 P05093 2/20 0.38
▸ SLC22A12 Q96S37 1/20 0.37
▸ HTR2C P28335 1/20 0.37

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
SCHEMBL2300302 0.80 CYP11B2 (0.51) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL12386965 0.80 CYP11B2 (0.51) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL12676858 0.77 CYP11B2 (0.51) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL20873080 0.76 NPC1 (0.54) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL1445121 0.76 CYP11B2 (0.50) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL20873066 0.75 PRKCZ (0.64) CYP11B2CYP11B1PRKCZCYP3A4CYP1A2
SCHEMBL17320797 0.74 PRKCZ (0.48) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL20873072 0.72 AR (0.49) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL13759475 0.72 CYP11B1 (0.51) CYP11B2CYP11B1PRKCZCNR1CNR2
SCHEMBL17320802 0.71 PRKCZ (0.44) CYP11B2CYP11B1PRKCZCNR1CNR2

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
EP-2351750-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME AS CONSTITUENT COMPONENT Tosoh Corporation (JP) 2011-08-03 — — EP disclosed
WO-2010038854-A1 1,3,5-TRIAZINE DERIVATIVE, PROCESS FOR PRODUCING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME AS CONSTITUENT COMPONENT 東ソー株式会社 (JP) 2010-04-08 — — WO disclosed
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