SCHEMBL22562227

SCHEMBL22562227

Cc1ccc(-c2ccc3c4ccccc4n(-c4cc(C(F)(F)F)cc(-n5c6ccccc6c6ccc(-c7ccc(C)cc7)cc65)c4-c4cccc(-c5ccccc5)n4)c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
TACR1 P25103 3/20 0.35
KIF11 P52732 1/20 0.34
PTPN5 P54829 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PDK2 Q15119 1/20 0.34
DHODH Q02127 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC2A1 P11166 1/20 0.33
ALDH1A3 P47895 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 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
SCHEMBL22562609 0.95 RAB9A (0.36) MAPTTACR1KIF11MEN1KMT2A
SCHEMBL22562231 0.93 KIF11 (0.36) MAPTTACR1KIF11MEN1KMT2A
SCHEMBL22562469 0.92 RAB9A (0.38) MAPTKIF11MEN1KMT2APDK2
SCHEMBL22562234 0.91 MAPT (0.38) MAPTTACR1PTPN5TRPV1MEN1
SCHEMBL22562473 0.90 GSK3B (0.33) MAPTTACR1KIF11TRPV1MEN1
SCHEMBL22562404 0.90 PDK2 (0.34) MAPTMEN1KMT2APDK2DHODH
SCHEMBL22562479 0.90 ALDH1A3 (0.37) MAPTKIF11PDK2KDM4EHPGD
SCHEMBL22562230 0.90 RAB9A (0.36) MAPTKIF11MEN1KMT2ADHODH
SCHEMBL22562232 0.89 GSK3B (0.35) MAPTTACR1KIF11MEN1KMT2A
SCHEMBL22562470 0.89 RAB9A (0.36) MAPTTACR1KIF11MEN1KMT2A

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