SCHEMBL14537573

SCHEMBL14537573

CCOC(=O)c1cnc2c(Sc3ccccc3)c(Sc3ccccc3)c(Sc3ccccc3)cc2c1Sc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.66
▸ ALDH1A1 P00352 3/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ ATM Q13315 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ TUBB4A P04350 2/20 0.47
▸ TUBB P07437 2/20 0.47
▸ TUBA3C P0DPH7 2/20 0.47
▸ TUBA1B P68363 2/20 0.47
▸ TUBA4A P68366 2/20 0.47
▸ TUBB4B P68371 2/20 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
SCHEMBL14537572 0.88 MAPT (0.71) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537571 0.86 MAPT (0.76) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537567 0.84 MAPT (0.70) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537570 0.84 MAPT (0.69) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537564 0.81 MAPT (0.79) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537569 0.81 MAPT (0.70) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537568 0.80 MAPT (0.72) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537595 0.78 MAPT (0.38) MAPTPOLBTDP1TUBB4ATUBB
SCHEMBL14537565 0.78 MAPT (0.70) MAPTALDH1A1NPSR1ATMSMN1; SMN2
SCHEMBL14537566 0.75 MAPT (0.69) MAPTALDH1A1NPSR1ATMSMN1; SMN2

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
US-8349867-B2 Quinoline compounds, intermediates, preparation methods and uses thereof SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2013-01-08 — — US disclosed
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