SCHEMBL23764083

SCHEMBL23764083

Cc1cccc(-c2cc(-c3cccc(C)c3)cc(N(c3ccccc3)c3ccc(-c4ccc5c6c(cccc46)-c4c-5c(-c5ccccc5)c5ccccc5c4-c4ccccc4)cc3)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.33
DHODH Q02127 1/20 0.33
ENPP1 P22413 1/20 0.32
CNR2 P34972 2/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ENPP3 O14638 1/20 0.31
ICMT O60725 2/20 0.30
PTPN1 P18031 1/20 0.30
MAPT P10636 2/20 0.30
CRHR1 P34998 1/20 0.30
PGR P06401 1/20 0.30
CNR1 P21554 1/20 0.30
NPC1 O15118 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 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
SCHEMBL23764074 0.91 HTT (0.33) PDK2ENPP1CNR2HSD17B1HSD17B2
SCHEMBL23764347 0.88 DHODH (0.33) DHODHENPP1CRHR1
SCHEMBL16484487 0.87 ENPP1 (0.38) ENPP1ALDH1A1NPSR1MAPTCRHR1
SCHEMBL12032283 0.87 ENPP1 (0.35) ENPP1ALDH1A1MAPT
SCHEMBL23764382 0.86 CYP1A2 (0.34) PDK2ALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL4078983 0.86 ENPP1 (0.35) ENPP1ALDH1A1MAPT
SCHEMBL12032229 0.86 ENPP1 (0.35) ENPP1ALDH1A1MAPT
SCHEMBL23764344 0.85 ENPP1 (0.30) ENPP1
SCHEMBL23764463 0.85 ENPP1 (0.33) ENPP1NPSR1CRHR1
SCHEMBL23764153 0.85 KDM4E (0.32) ENPP1CNR2ALDH1A1HPGDHTT

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