SCHEMBL8663516

SCHEMBL8663516

Cc1ccc(C2=NC(c3cccc4ccccc34)(C3(c4cccc5ccccc45)N=C(c4ccc(C)cc4)C(c4ccc(C)cc4)=N3)N=C2c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.37
CYP2A6 P11509 1/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
POLB P06746 1/20 0.37
STAT1 P42224 1/20 0.37
XBP1 P17861 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
EGFR P00533 2/20 0.36
ERBB2 P04626 2/20 0.36
ADORA2A P29274 1/20 0.36
TNKS O95271 2/20 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
SCHEMBL8666981 0.86 MAPT (0.39) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL8667184 0.84 CYP1A2 (0.38) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL491196 0.83 RAB9A (0.43) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8668248 0.77 ALDH1A1 (0.46) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL1877506 0.77 TAAR1 (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL491300 0.76 SLC6A3 (0.39) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL8663506 0.71 CYP1A2 (0.46) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL8665969 0.71 CYP2A6 (0.43) MAPTMAPK1KDM4EMEN1KMT2A
SCHEMBL8665808 0.70 CYP1A2 (0.45) KDM4EMEN1KMT2AALDH1A1CYP2A6
SCHEMBL2689653 0.70 WDR5 (0.37) MAPTMAPK1KDM4EALDH1A1CYP2A6

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
US-5792589-A ORGANIC BINDER; OPTICALLY CROSSLINKABLE COMPOUND; RADICAL-GENERATING AGENT: 2,4,5-TRIARYL IMIDAZOLE DIMER, AMINO-GROUP CONTAINING BENZOPHENONE PHOTOSENSITIZER, A THIOL COMPOUND JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1998-08-11 US disclosed