SCHEMBL20937436

SCHEMBL20937436

Cc1cc(C)cc(-c2ccc3c4ccccc4n(-c4cc(-c5cccnc5)ccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
MAPK1 P28482 3/20 0.38
HTT P42858 1/20 0.38
CYP11B2 P19099 4/20 0.37
CYP3A4 P08684 4/20 0.37
CYP11B1 P15538 3/20 0.37
CYP17A1 P05093 2/20 0.37
CYP19A1 P11511 2/20 0.37
CYP1A2 P05177 3/20 0.37
CYP2D6 P10635 3/20 0.37
ALDH1A1 P00352 3/20 0.37
TSHR P16473 3/20 0.37
CYP2C9 P11712 2/20 0.37
CLK4 Q9HAZ1 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
METAP2 P50579 1/20 0.37
GLA P06280 1/20 0.37
CHEK1 O14757 1/20 0.36
MDM2 Q00987 1/20 0.36

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
SCHEMBL20937426 0.97 CYP11B2 (0.39) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937417 0.94 MAPK1 (0.38) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937431 0.93 MAPT (0.41) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937726 0.92 CYP11B2 (0.39) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937379 0.92 MAPT (0.39) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937399 0.92 CYP11B1 (0.40) MAPTMAPK1CYP11B2CYP3A4CYP11B1
SCHEMBL20937439 0.92 CHEK1 (0.37) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937410 0.91 CYP11B2 (0.38) MAPTMAPK1HTTCYP11B2CYP3A4
SCHEMBL20937423 0.91 CYP3A4 (0.40) MAPTMAPK1CYP11B2CYP3A4CYP11B1
SCHEMBL20937402 0.90 MAPT (0.40) MAPTMAPK1HTTCYP11B2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019076844-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-25 WO disclosed