SCHEMBL23764418

SCHEMBL23764418

CC1(C)C=CC=C(N(c2ccccc2)c2ccc3cccnc3c2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
PDE10A Q9Y233 1/20 0.35
MEN1 O00255 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
NR4A2 P43354 1/20 0.34
CYP3A4 P08684 2/20 0.34
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
CYP2D6 P10635 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
NPC1 O15118 2/20 0.32
DOT1L Q8TEK3 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30

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
SCHEMBL20629310 0.84 HTT (0.30) HTT
SCHEMBL23764523 0.81 DOT1L (0.35) ALDH1A1PDE10ACASP1HTTNPC1
SCHEMBL23764414 0.80
SCHEMBL23764235 0.80 NPC1 (0.41) ALDH1A1MEN1KMT2ACYP1A2CYP2C19
SCHEMBL23764408 0.79 NCF1 (0.41) CYP1A2HTT
SCHEMBL23764415 0.78 LMNA (0.38) ALDH1A1MEN1KMT2AHTTCYP3A4
SCHEMBL23764233 0.78 CYP1A2 (0.37) MEN1KMT2ACYP1A2CYP2C19CYP2D6
SCHEMBL23764237 0.77 TGFBR1 (0.34) NPC1RAB9A
SCHEMBL16484712 0.77 ALDH1A1 (0.50) ALDH1A1PDE10AMEN1CASP1CASP7
SCHEMBL23764230 0.76 ACVR1 (0.37) CYP1A2

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-2907803-B1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT TORAY INDUSTRIES (JP) 2021-08-18 EP disclosed