SCHEMBL22562474

SCHEMBL22562474

Cc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C)c4)ccc2n3-c2cc(C(F)(F)F)cc(-n3c4ccc(-c5cc(C)cc(C)c5)cc4c4cc(-c5cc(C)cc(C)c5)ccc43)c2-c2cccc(-c3ccccc3)n2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.35
MAT2A P31153 1/20 0.34
PDK2 Q15119 1/20 0.34
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
ICMT O60725 1/20 0.33
MAPT P10636 2/20 0.33
DHODH Q02127 1/20 0.33
ENPP1 P22413 1/20 0.33
TRPV3 Q8NET8 4/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
KDM1A O60341 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32

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
SCHEMBL22562234 0.93 MAPT (0.38) GSK3BMAT2APDK2MEN1RAB9A
SCHEMBL22562228 0.92 ENPP1 (0.38) GSK3BMAT2APDK2KMT2AICMT
SCHEMBL22562404 0.92 PDK2 (0.34) GSK3BMAT2APDK2MEN1RAB9A
SCHEMBL22562392 0.91 ICMT (0.37) GSK3BMEN1RAB9AKMT2AICMT
SCHEMBL22562468 0.91 RAB9A (0.38) PDK2MEN1RAB9AKMT2AMAPT
SCHEMBL22562471 0.89 GSK3B (0.34) GSK3BMAT2AMEN1RAB9AKMT2A
SCHEMBL22562470 0.88 RAB9A (0.36) MEN1RAB9AKMT2AMAPTTRPV3
SCHEMBL22562232 0.86 GSK3B (0.35) GSK3BMAT2AMEN1RAB9AKMT2A
SCHEMBL22562303 0.86 MEN1 (0.36) PDK2MEN1RAB9AKMT2AMAPT
SCHEMBL22562406 0.86 RAB9A (0.39) GSK3BMEN1RAB9AKMT2AMAPT

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
EP-3418278-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP disclosed