SCHEMBL8426306

SCHEMBL8426306

CC(C)(C)c1ccc(-c2ccccc2)c(OP(=O)(O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.47
EGFR P00533 1/20 0.42
INPPL1 O15357 4/20 0.42
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
PLA2G1B P04054 1/20 0.41
NFKB1 P19838 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
PDE3A Q14432 1/20 0.41

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
SCHEMBL8594515 0.88 GPR84 (0.47) GPR84INPPL1ALDH1A1NPC1PLA2G1B
SCHEMBL8426305 0.88 NPC1 (0.44) GPR84EGFRALDH1A1NPC1PLA2G1B
SCHEMBL9342885 0.82 GPR84 (0.40) GPR84EGFRALDH1A1NPC1PLA2G1B
Phosphoric Acid SCHEMBL28891147 0.80 NPC1 (0.51) GPR84ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL3287701 0.78 SRC (0.41) GPR84INPPL1ALDH1A1KDM4EUSP2
SCHEMBL27747234 0.76 INPPL1 (0.45) INPPL1ALDH1A1KDM4EUSP2HPGD
SCHEMBL28996775 0.76 INPPL1 (0.45) INPPL1ALDH1A1KDM4EHPGDHSD17B10
Pyrophosphoric Acid SCHEMBL30303117 0.76 PTPN5 (0.42) GPR84EGFRALDH1A1NPC1PLA2G1B
Pyrophosphoric Acid SCHEMBL28417744 0.76 PTPN5 (0.42) GPR84EGFRALDH1A1NPC1PLA2G1B
SCHEMBL8594511 0.76 NPC1 (0.44) GPR84ALDH1A1NPC1PLA2G1BNFKB1

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-0661588-B1 Color photographic element EASTMAN KODAK CO (US) 1999-10-20 EP disclosed
EP-0661588-A2 Color photographic element EASTMAN KODAK COMPANY (US) 1995-07-05 EP disclosed