SCHEMBL626557

SCHEMBL626557

Cc1ccccc1C(=O)c1ccc2c(c1)c1cc(CC=O)ccc1n2C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
HTT P42858 1/20 0.55
KDM4E B2RXH2 3/20 0.45
MAPT P10636 3/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 2/20 0.44
RORC P51449 2/20 0.40
MAPK13 O15264 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
CNR2 P34972 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
FFAR1 O14842 1/20 0.37
SRD5A2 P31213 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLA P06280 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL625395 0.89 HPGD (0.51) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL625639 0.88 ALDH1A1 (0.47) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL21578032 0.83 ALDH1A1 (0.64) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL31145039 0.82 ALDH1A1 (0.63) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL626556 0.82 ALDH1A1 (0.63) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL29503076 0.77 ALDH1A1 (0.50) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL27767481 0.77 ALDH1A1 (0.50) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL29610939 0.77 ALDH1A1 (0.50) ALDH1A1HTTKDM4EMAPTHPGD
SCHEMBL15906317 0.76 MAPT (0.60) ALDH1A1HTTKDM4EMAPTSMN1; SMN2
SCHEMBL24494726 0.76 ALDH1A1 (0.57) ALDH1A1HTTKDM4EMAPTHPGD

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
WO-2012020715-A1 BLUE CURABLE COMPOSITION, COLOR FILTER AND METHOD FOR PRODUCING THE SAME, SOLID-STATE IMAGE PICKUP DEVICE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-02-16 WO disclosed