SCHEMBL30516128

SCHEMBL30516128

O=C1c2ccccc2C(=O)c2c1cccc2-n1nnc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 1/20 0.53
MAPT P10636 7/20 0.49
NPC1 O15118 4/20 0.49
ALDH1A1 P00352 4/20 0.49
APAF1 O14727 3/20 0.49
TDP1 Q9NUW8 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
TDP2 O95551 2/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
THRB P10828 1/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
BLM P54132 1/20 0.49
SMAD3 P84022 1/20 0.49
HKDC1 Q2TB90 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
EGFR P00533 2/20 0.48
MAPK1 P28482 2/20 0.48

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
SCHEMBL15537391 1.00 KCNMA1 (0.53) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL13604189 0.77 MAPT (0.47) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL19649394 0.74 KCNMA1 (0.50) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL11406837 0.74 MAPT (0.59) MAPTNPC1ALDH1A1TDP1NPSR1
SCHEMBL15693720 0.73 KCNMA1 (0.60) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL23840194 0.73 KCNMA1 (0.64) KCNMA1MAPTALDH1A1TDP1NPSR1
SCHEMBL25862494 0.73 KCNMA1 (0.64) KCNMA1MAPTALDH1A1NPSR1LMNA
SCHEMBL31729992 0.72 KCNMA1 (0.54) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL14483923 0.70 KCNMA1 (0.49) KCNMA1MAPTNPC1ALDH1A1APAF1
SCHEMBL14421241 0.70 KCNMA1 (0.60) KCNMA1MAPTNPC1ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3548022-B1 COMPOSITIONS FOR MODULATING PD-1 SIGNAL TRANSDUCTION UNIV RES INST INC AUGUSTA (US) 2023-11-22 EP claimed
CN-116585315-A Compositions for modulating PD-1 signaling 奥古斯塔大学研究所公司 2023-08-15 CN claimed
CN-116585315-A Compositions for modulating PD-1 signaling 奥古斯塔大学研究所公司 2023-08-15 CN disclosed