SCHEMBL29645822

SCHEMBL29645822

COc1cccc(-c2nc3c4ccc(F)cc4nc(Nc4ccccnc4=O)n3n2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ABCG2 Q9UNQ0 4/20 0.42
THRB P10828 3/20 0.42
TP53 P04637 2/20 0.42
RXFP1 Q9HBX9 2/20 0.40
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
ABCB1 P08183 1/20 0.39
ZAP70 P43403 1/20 0.39
SYK P43405 1/20 0.39

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
SCHEMBL29646058 0.93 MAPT (0.47) MAPTSMN1; SMN2ABCG2THRBTP53
SCHEMBL29645889 0.91 MAPT (0.47) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL29645482 0.91 MAPT (0.53) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL29646003 0.90 MAPT (0.56) MAPTSMN1; SMN2ABCG2THRBTP53
SCHEMBL29645650 0.86 MAPT (0.50) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL29645635 0.85 MAPT (0.44) MAPTSMN1; SMN2ABCG2THRBTP53
SCHEMBL29645544 0.85 MAPT (0.53) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL29645577 0.84 MAPT (0.45) MAPTSMN1; SMN2ABCG2THRBTP53
SCHEMBL29645988 0.84 MAPT (0.47) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL29645458 0.84 MAPT (0.50) MAPTSMN1; SMN2THRBTP53RXFP1

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-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN claimed