SCHEMBL30341897

SCHEMBL30341897

Cc1ccc(C(=O)c2cc(-c3ccc(N)c(C(=O)c4ccc(C)cc4)c3)ccc2N)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.71
NPC1 O15118 1/20 0.66
MAPK1 P28482 1/20 0.66
HTT P42858 1/20 0.66
L3MBTL1 Q9Y468 2/20 0.56
LMNA P02545 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
KDM4E B2RXH2 1/20 0.53
GFER P55789 1/20 0.53
KMT2A Q03164 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
AKR1C3 P42330 1/20 0.51
IKBKB O14920 1/20 0.50
POLB P06746 1/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
MCL1 Q07820 1/20 0.46

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
SCHEMBL30341898 0.84 IKBKB (0.71) MAPTNPC1MAPK1HTTLMNA
SCHEMBL5559119 0.83 MAPT (0.68) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL30341894 0.83 MAPT (0.68) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL4259849 0.83 MAPT (1.00) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL10396907 0.83 MAPT (0.67) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL4639277 0.81 MAPT (0.71) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL14579889 0.81 SRD5A2 (0.50) MAPTNPC1MAPK1HTTSMN1; SMN2
SCHEMBL5383825 0.80 MAPT (0.73) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL31366618 0.80 MAPT (0.73) MAPTNPC1MAPK1HTTL3MBTL1
SCHEMBL8898237 0.80 KMT2A (0.78) MAPTSMN1; SMN2ALDH1A1KDM4EGFER

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
CN-111303417-B Photocrosslinkable polyimide resin 上海极紫科技有限公司 2023-03-21 CN disclosed