SCHEMBL28054801

SCHEMBL28054801

CC(=O)Oc1scc(N)c1C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
ACHE P22303 1/20 0.32
ALDH1A1 P00352 2/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP19A1 P11511 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL27374876 0.77 LMNA (0.35) LMNAACHEALDH1A1CYP19A1MEN1
SCHEMBL27866713 0.73 GSK3B (0.32) LMNACYP19A1
SCHEMBL27565969 0.72 LMNA (0.31) LMNA
SCHEMBL6609300 0.71 RAB9A (0.37) LMNAALDH1A1POLBMAPK1CYP19A1
SCHEMBL17678405 0.69 KDM4E (0.37) LMNAALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL27619881 0.69 LMNA (0.35) LMNAACHEALDH1A1MAPT
SCHEMBL9430732 0.65 GPR35 (0.44) ALDH1A1POLBMEN1KMT2A
SCHEMBL16212934 0.65 KDM4E (0.49) LMNAALDH1A1POLBMAPK1SMN1; SMN2
SCHEMBL28794324 0.65 LMNA (0.35) LMNAACHEALDH1A1POLBSMN1; SMN2
SCHEMBL27650991 0.65 KDM4E (0.33) LMNAALDH1A1CYP19A1RAB9A

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
CN-105308038-A Enhancer of zeste homolog 2 inhibitors GLAXOSMITHKLINE IP NO 2 LTD 2016-02-03 CN disclosed