SCHEMBL23845487

SCHEMBL23845487

CN(C)Sc1ccc(Cl)nc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
PIK3CD O00329 1/20 0.35
NAPRT Q6XQN6 1/20 0.35
POLB P06746 1/20 0.34
DGAT1 O75907 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 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
SCHEMBL1145839 0.76
SCHEMBL29978927 0.76
SCHEMBL10280707 0.75 PIK3CD (0.41) MAPTCHRNA3PIK3CDNAPRTPOLB
SCHEMBL1145837 0.71
SCHEMBL21288402 0.71
SCHEMBL29687635 0.71 DGAT1 (0.41) MAPTPIK3CDNAPRTDGAT1ALDH1A1
SCHEMBL23845466 0.71 DGAT1 (0.37) PIK3CDNAPRTPOLBDGAT1
SCHEMBL23833573 0.71 SMN1; SMN2 (0.41) SMN1; SMN2PIK3CDNAPRTPOLBDGAT1
SCHEMBL30094648 0.71 SMN1; SMN2 (0.41) SMN1; SMN2PIK3CDNAPRTPOLBDGAT1
SCHEMBL16676162 0.71 DGAT1 (0.41) MAPTPIK3CDNAPRTDGAT1ALDH1A1

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
WO-2021188938-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND USE AKEBIA THERAPEUTICS, INC. (US) 2021-09-23 WO disclosed