SCHEMBL474979

SCHEMBL474979

CC1(C)Cc2c(C(=O)O)ccc(C(=O)O)c2C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 6/20 0.39
ALOX15 P16050 1/20 0.39
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
SPR P35270 1/20 0.38
TP53 P04637 1/20 0.37
SELL P14151 1/20 0.37
SELP P16109 1/20 0.37
KEAP1 Q14145 1/20 0.36
TSHR P16473 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35

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
SCHEMBL8186132 0.77 KMT2A (0.49) SMN1; SMN2L3MBTL1KMT2AALDH1A1KDM4E
SCHEMBL6903096 0.75 CYP1A2 (0.38) CYP1A2SMN1; SMN2L3MBTL1ALDH1A1ALOX15
SCHEMBL524621 0.72 CYP1A2 (0.39) CYP1A2SMN1; SMN2KMT2AALDH1A1ALOX15
SCHEMBL21688 0.72 CYP1A2 (0.63) CYP1A2SMN1; SMN2GAAALDH1A1ALOX15
SCHEMBL29769278 0.72 CYP1A2 (0.63) CYP1A2SMN1; SMN2GAAALDH1A1ALOX15
Hydrochloric Acid SCHEMBL607308 0.70 CYP1A2 (0.60) CYP1A2SMN1; SMN2GAAKMT2AALDH1A1
SCHEMBL17980049 0.70 LMNA (0.45) CYP1A2GAAKMT2AALDH1A1ALOX15
SCHEMBL251512 0.69 CYP1A2 (0.57) CYP1A2SMN1; SMN2GAAALDH1A1ALOX15
Cyclohexane SCHEMBL483378 0.69 CYP1A2 (0.57) CYP1A2SMN1; SMN2GAAALDH1A1ALOX15
SCHEMBL87519 0.69 CYP1A2 (0.57) CYP1A2SMN1; SMN2GAAKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2337685-B1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM MITSUBISHI POLYESTER FILM GMBH (DE) 2012-02-01 EP claimed
EP-2337685-A1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM Mitsubishi Polyester Film GmbH (DE) 2011-06-29 EP claimed
WO-2010028774-A1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM MITSUBISHI POLYESTER FILM GMBH (DE) 2010-03-18 WO claimed
EP-2337685-B1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM MITSUBISHI POLYESTER FILM GMBH (DE) 2012-02-01 EP disclosed
EP-2337685-A1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM Mitsubishi Polyester Film GmbH (DE) 2011-06-29 EP disclosed
WO-2010028774-A1 SEALABLE, BIAXIALLY ORIENTED POLYESTER FILM MITSUBISHI POLYESTER FILM GMBH (DE) 2010-03-18 WO disclosed