SCHEMBL5548627

SCHEMBL5548627

Cc1cc(Cl)ccc1-c1nc(C)c([C]=O)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.38
KDM4E B2RXH2 3/20 0.36
MAPT P10636 3/20 0.36
CASP3 P42574 2/20 0.36
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 3/20 0.35
GRM2 Q14416 1/20 0.35
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
CRHR1 P34998 1/20 0.34
NPBWR1 P48145 1/20 0.34
AGPAT2 O15120 1/20 0.34
SHMT1 P34896 1/20 0.33
SHMT2 P34897 1/20 0.33
LMNA P02545 2/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL5552943 0.88 KDM4E (0.47) KDM4EMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL5552339 0.85 AGPAT2 (0.42) KDM4EMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL14960175 0.77 CASP3 (0.41) NOTUMKDM4EMAPTCASP3RAB9A
SCHEMBL19936600 0.76 CASP3 (0.40) NOTUMKDM4EMAPTCASP3RAB9A
SCHEMBL3436648 0.75 KDM4E (0.65) KDM4EMAPTCASP3RAB9ASMN1; SMN2
SCHEMBL3436690 0.73 KDM4E (0.42) NOTUMKDM4EMAPTCASP3RAB9A
SCHEMBL14800709 0.71 GAA (0.68) KDM4EMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL28288912 0.68 MEN1 (0.44) NOTUMKDM4EMAPTCASP3RAB9A
SCHEMBL3183519 0.68 MIF (0.48) NOTUMKDM4EMAPTRAB9ASMN1; SMN2
SCHEMBL14960117 0.67 ADORA2A (0.39) NOTUMKDM4EMAPTCASP3RAB9A

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-105753858-B Heterocyclic compound and p27Kip1Decomposing inhibitor ASKA制药株式会社 2019-04-30 CN disclosed
WO-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 WO disclosed