SCHEMBL9232030

SCHEMBL9232030

COc1nn(C)c(C(=O)NCc2ccc(C(C)(C)C)cc2)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ GALR3 O60755 1/20 0.56
▸ NR2F2 P24468 1/20 0.56
▸ EPHX2 P34913 10/20 0.53
▸ NR1H4 Q96RI1 9/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ MAPT P10636 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ PPARG P37231 2/20 0.46
▸ PPARD Q03181 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
SCHEMBL11938554 0.85 LMNA (0.55) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL9527642 0.85 LMNA (0.77) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL11938556 0.84 LMNA (0.58) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL11938558 0.83 LMNA (0.57) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL20968008 0.83 LMNA (0.57) LMNAKMT2ARAB9ASMN1; SMN2GALR3
Tebufenpyrad SCHEMBL26848 0.83 LMNA (0.59) LMNAKMT2ARAB9ASMN1; SMN2GALR3
Tebufenpyrad SCHEMBL8407688 0.83 LMNA (0.59) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL19185689 0.82 LMNA (0.56) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL11938501 0.81 LMNA (0.55) LMNAKMT2ARAB9ASMN1; SMN2GALR3
SCHEMBL11938560 0.81 LMNA (0.55) LMNAKMT2ARAB9ASMN1; SMN2GALR3

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
JP-7173139-A — — None — — JP disclosed
JP-H07173139-A ALKOXYPYRAZOLECARBOXAMIDE, AND INSECTICIDE, ACARICIDE AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT MITSUBISHI CHEM CORP 1995-07-11 — — JP disclosed
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