SCHEMBL22474326

SCHEMBL22474326

COc1ccnc(C(=O)N[C@@H](C)C(=O)O[C@@H](C)[C@H](C)Oc2ccccc2)c1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ RECQL P46063 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ CTSA P10619 1/20 0.35
▸ TDP1 Q9NUW8 4/20 0.34
▸ ATM Q13315 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ BRD4 O60885 1/20 0.32

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
SCHEMBL17901290 1.00 MAPT (0.36) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17905565 0.92 MAPT (0.35) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL19726752 0.92 MAPT (0.35) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL20682792 0.92 MAPT (0.35) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17901148 0.92 MAPT (0.35) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17901040 0.92 MAPT (0.35) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17901283 0.91 MAPT (0.37) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17901282 0.91 MAPT (0.37) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17900737 0.91 MAPT (0.37) MAPTALDH1A1KMT2AMEN1NPSR1
SCHEMBL17900791 0.91 MAPT (0.37) MAPTALDH1A1KMT2AMEN1NPSR1

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
EP-3255991-B1 PICOLINAMIDES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2020-09-30 — — EP disclosed
Send feedback