SCHEMBL28059182

SCHEMBL28059182

COc1ccc(-c2cc(SNC(N)=O)n[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.54
MAPT P10636 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MAPK1 P28482 1/20 0.51
CSNK2A2 P19784 1/20 0.49
CSNK2A1 P68400 1/20 0.49
NPY5R Q15761 1/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
ALPL P05186 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TNIK Q9UKE5 5/20 0.44
SCN4A P35499 1/20 0.43
CA9 Q16790 1/20 0.43
CDC7 O00311 1/20 0.43
CHRNA3 P32297 1/20 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
SCHEMBL4557695 0.76 DYRK1A (0.60) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL27345974 0.74 CA1 (0.46) NPC1RAB9A
SCHEMBL8368151 0.73 MAPT (0.58) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL27527894 0.72 CA1 (0.50) NPC1RAB9ASMN1; SMN2
SCHEMBL1413939 0.72 MAPT (0.59) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL7930564 0.71 CSNK2A2 (0.65) CSNK2A2CSNK2A1NPY5RCHRNA3KCNH2
SCHEMBL28059172 0.71 RAB9A (0.62) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL5838154 0.70 RAB9A (0.67) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL1143140 0.70 DYRK1A (1.00) DYRK1AMAPTNPC1RAB9AMAPK1
SCHEMBL28059181 0.70 CSNK2A2 (0.60) DYRK1AMAPTNPC1RAB9AMAPK1

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-102656141-B Micromolecular compound of simulation hemopoieticgrowth factor and uses thereof LIGAND PHARMACEUTICALS INC. (US) 2016-04-06 CN disclosed