SCHEMBL27488151

SCHEMBL27488151

CC(C)(C)OC(=O)NC(=O)Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ TP53 P04637 1/20 0.53
▸ EPHX1 P07099 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ EPHX2 P34913 1/20 0.53
▸ CDK9 P50750 1/20 0.53
▸ CLK4 Q9HAZ1 1/20 0.53
▸ NPC1 O15118 4/20 0.51
▸ RAB9A P51151 4/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TAAR1 Q96RJ0 3/20 0.49
▸ CTSK P43235 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ CASP3 P42574 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ MAPT P10636 1/20 0.46
▸ MAOA P21397 1/20 0.46
▸ MAOB P27338 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
SCHEMBL3461792 0.86 SMN1; SMN2 (0.59) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL775002 0.85 NAMPT (0.56) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL27846204 0.85 POLB (0.61) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL3460916 0.82 KMT2A (0.55) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL15284035 0.81 SMN1; SMN2 (0.58) SMN1; SMN2TP53EPHX1TSHREPHX2
Alcohol SCHEMBL4315662 0.79 NAMPT (0.51) SMN1; SMN2NPC1RAB9ACTSKLMNA
SCHEMBL9479696 0.79 MAPT (0.58) SMN1; SMN2RAB9AKMT2AMEN1LMNA
SCHEMBL27942342 0.79 PDK1 (0.51) SMN1; SMN2NPC1LMNAPOLBNAPRT
SCHEMBL13785635 0.79 CTSK (0.41) NPC1RAB9AKMT2AMEN1CTSK
SCHEMBL31617997 0.79 EPHX1 (0.58) SMN1; SMN2EPHX1KMT2AMEN1CTSK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1161331-C Hydrazine derivative - 2004-08-11 — — CN disclosed
CN-1265096-A Hydrazine derivatives HOFFMANN LA ROCHE (CH) 2000-08-30 — — CN disclosed
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