SCHEMBL7757952

SCHEMBL7757952

COc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1.Clc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.54
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CXCR2 P25025 1/20 0.41
DPP8 Q6V1X1 2/20 0.41
DPP9 Q86TI2 2/20 0.41
MARS1 P56192 1/20 0.41
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
PIK3CA P42336 1/20 0.40

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
SCHEMBL5692393 0.86 SMN1; SMN2 (0.55) DPP4MAPTMAPK1RAB9ANPC1
SCHEMBL143628 0.83 CYP3A4 (0.44) DPP4CNR1CNR2MAPTLMNA
SCHEMBL29401780 0.83 CYP3A4 (0.44) DPP4CNR1CNR2MAPTLMNA
SCHEMBL36116 0.83 CLK4 (0.48) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL22129825 0.83 CLK4 (0.48) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL10068859 0.82 CLK4 (0.47) MAPTL3MBTL1ALDH1A1MAPK1RAB9A
Ethylene SCHEMBL22497430 0.80 CLK4 (0.46) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL326391 0.80 CLK4 (0.48) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7114873 0.78 S1PR1 (0.53) DPP4MAPTLMNAL3MBTL1ALDH1A1
SCHEMBL18344284 0.76 KDM4E (0.44) MAPTL3MBTL1ALDH1A1RAB9ANPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0860741-B1 Photopolymerizable composition FUJI PHOTO FILM CO LTD (JP) 2001-05-16 EP disclosed
EP-0860741-A1 Photopolymerizable composition FUJI PHOTO FILM CO., LTD. (JP) 1998-08-26 EP disclosed