SCHEMBL31079418

SCHEMBL31079418

CC(C)(c1ccccc1)c1cc(Cc2cc(C(C)(C)c3ccccc3)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
LMNA P02545 1/20 0.40
POLB P06746 2/20 0.40
ALDH1A1 P00352 4/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CYP3A4 P08684 2/20 0.38
CNR1 P21554 3/20 0.36
CNR2 P34972 3/20 0.36
ALOX15 P16050 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 4/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
HPGD P15428 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL675255 1.00 NPC1 (0.44) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL31267653 1.00 NPC1 (0.44) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL14323123 0.94 NPC1 (0.41) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL11346033 0.89 NPC1 (0.38) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL699155 0.88 NPC1 (0.47) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL9868106 0.87 NPC1 (0.40) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL2380314 0.85 NPC1 (0.45) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL7701678 0.85 NPC1 (0.47) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL8861285 0.85 NPC1 (0.50) NPC1RAB9ALMNAPOLBALDH1A1
SCHEMBL14324434 0.84 MEN1 (0.40) NPC1RAB9APOLBCYP3A4CNR1

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
WO-2024154752-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT, COLOR FILTER, LIGHT SCATTERING LAYER, AND IMAGE DISPLAY DEVICE 三菱ケミカル株式会社 2024-07-25 WO disclosed