SCHEMBL11223178

SCHEMBL11223178

CC(C)(C)c1ccc(C(=O)O)c(-c2ccccc2C(=O)O)c1-c1ccccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.53
ALDH1A1 P00352 6/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
HNF4A P41235 1/20 0.42
ALOX15 P16050 1/20 0.42
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GFER P55789 1/20 0.40
KMT2A Q03164 1/20 0.40
SOS1 Q07889 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX12 P18054 1/20 0.40
WDR5 P61964 1/20 0.40
KDM4E B2RXH2 2/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL11061912 0.84 MYC (0.64) MYCALDH1A1L3MBTL1MAPTLMNA
SCHEMBL31028133 0.78 ALDH1A1 (0.56) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL39249 0.78 ALDH1A1 (0.56) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL28065800 0.78 HNF4A (0.47) MYCALDH1A1L3MBTL1MAPTLMNA
SCHEMBL8616914 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL10955296 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL4737094 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL22060 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL4787076 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E
SCHEMBL10960705 0.76 ALDH1A1 (0.54) ALDH1A1MAPTLMNAALOX15KDM4E

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-0009529-B1 RUBBER-MODIFIED TERPOLYMER AND PROCESS FOR ITS PRODUCTION MONSANTO COMPANY (US) 1982-07-28 EP claimed