SCHEMBL10429487

SCHEMBL10429487

COc1ccccc1Nc1nc(O)cc(O)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
ALDH1A1 P00352 5/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
KDM4E B2RXH2 2/20 0.64
KMT2A Q03164 1/20 0.64
EGFR P00533 1/20 0.55
NPSR1 Q6W5P4 1/20 0.54
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
GAA P10253 2/20 0.53
MAPK10 P53779 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
GBA1 P04062 3/20 0.52
HPGD P15428 2/20 0.51
POLB P06746 1/20 0.50
USP2 O75604 2/20 0.49
TSHR P16473 2/20 0.49
RAD52 P43351 2/20 0.49
TTK P33981 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL11813903 0.86 MAPT (0.83) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL9697643 0.78 MAPT (0.66) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL6237782 0.78 MAPT (0.93) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL29609022 0.78 MAPT (0.93) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL10429482 0.77 NPSR1 (0.53) MAPTALDH1A1SMN1; SMN2KMT2ANPSR1
SCHEMBL27978206 0.77 MAPT (0.65) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL3191755 0.75 MAPT (0.69) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL20004385 0.75 EGFR (0.71) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL10358576 0.75 GBA1 (0.85) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL20355106 0.75 HTT (0.60) MAPTALDH1A1SMN1; SMN2KDM4EKMT2A

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-4942225-A Preparation of diazo and azo compounds using azidoformamidium salts BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed