SCHEMBL16601988

SCHEMBL16601988

CCC(C(=O)O)N1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(c1ccccc1)C3=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
GAA P10253 2/20 0.48
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
POLB P06746 4/20 0.47
KDM4E B2RXH2 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
APOBEC3A P31941 1/20 0.47
RECQL P46063 1/20 0.47
CASP6 P55212 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
HPGD P15428 1/20 0.47
ALOX12 P18054 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL16602053 0.82 ALDH1A1 (0.45) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL32691229 0.82 ALDH1A1 (0.68) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL20835844 0.82 ALDH1A1 (0.68) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL512864 0.82 ALDH1A1 (0.68) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL10201311 0.82 ALDH1A1 (0.68) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL16601637 0.81 POLB (0.44) ALDH1A1GAAPPARGPPARDPPARA
SCHEMBL16601822 0.79 ANPEP (0.50) ALDH1A1GAAPOLBKDM4EL3MBTL1
SCHEMBL10898781 0.78 KDM4E (0.57) ALDH1A1GAAPOLBKDM4ETP53
SCHEMBL16601638 0.78 KMT2A (0.46) ALDH1A1GAAPPARGPPARDPPARA
SCHEMBL16601667 0.78 ALDH1A1 (0.46) ALDH1A1GAAPPARGPPARDPPARA

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
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed