SCHEMBL27677399

SCHEMBL27677399

CC(C)(C)C(=O)ON1CCC[C@H](NC(=O)c2sc(-c3ccc(Cl)cc3)cc2N)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ POLB P06746 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ IKBKB O14920 1/20 0.43
▸ PPARA Q07869 4/20 0.42
▸ CNR1 P21554 4/20 0.42
▸ CNR2 P34972 4/20 0.42
▸ CHEK1 O14757 4/20 0.42

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
SCHEMBL28788213 0.88 CHEK1 (0.47) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL1564849 0.84 CNR1 (0.57) MAPTKDM4ERAB9AALDH1A1KMT2A
SCHEMBL5554830 0.81 MAPT (0.54) MAPTKDM4ERAB9AALDH1A1KMT2A
SCHEMBL27677393 0.79 CHEK1 (0.54) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL27677400 0.79 CHEK1 (0.54) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL31532571 0.75 USP30 (0.53) CNR1CNR2
SCHEMBL31532568 0.75 USP30 (0.53) CNR1CNR2
SCHEMBL27819440 0.74 DRD4 (0.42) KDM4ERAB9AALDH1A1KMT2AMEN1
SCHEMBL31532672 0.74 USP30 (0.56) CNR1CNR2
SCHEMBL1564850 0.73 MAPT (0.49) MAPTKDM4ERAB9AALDH1A1KMT2A

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-100584840-C Substituted heterocyclic compounds and uses thereof ASTRAZENECA AB 2010-01-27 — — CN disclosed
CN-1922172-A Substituted heterocyclic compounds and uses thereof ASTRAZENECA AB (SE) 2007-02-28 — — CN disclosed
Send feedback