SCHEMBL24377637

SCHEMBL24377637

Clc1cc2[nH]cc(C3=CCOCC3)c2cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
PIK3CD O00329 2/20 0.36
PIK3CA P42336 2/20 0.36
PIK3CB P42338 2/20 0.36
PIK3CG P48736 2/20 0.36
SLC6A4 P31645 2/20 0.33
MAPK14 Q16539 1/20 0.33
JAK3 P52333 1/20 0.33
PDE10A Q9Y233 1/20 0.32
CDC7 O00311 1/20 0.32
CDK2 P24941 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
ATR Q13535 2/20 0.32
ATRIP Q8WXE1 1/20 0.32
PRPS1 P60891 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
PRKAB2 O43741 1/20 0.31

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
SCHEMBL24377932 0.74 SLC6A4 (0.62) SLC6A4
SCHEMBL24377636 0.74 SLC6A4 (0.45) SLC6A4
SCHEMBL29546618 0.74 SLC6A4 (0.62) SLC6A4
SCHEMBL22128362 0.73 IMPDH2 (0.47) PIM1PIM2SLC6A4
SCHEMBL20200677 0.68 PIK3CD (0.42) PIK3CDPIK3CAPIK3CBPIK3CGMAPK14
SCHEMBL18988775 0.68 PIK3CA (0.42) PIK3CDPIK3CAPIK3CBPIK3CGMAPK14
SCHEMBL14529647 0.68 AR (0.43) PIM1PIM2SLC6A4MAPK14JAK3
SCHEMBL23536642 0.68 PIM1 (0.42) PIM1PIM2PIK3CDPIK3CAMAPK14
SCHEMBL2431741 0.68 JAK3 (0.36) PIM1PIM2PIK3CDPIK3CAPIK3CB
SCHEMBL30632800 0.66 PRKAB2 (0.44) PIK3CDPIK3CAPIK3CBPRKAB2PRKAG1

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-2022083560-A1 TYK2 SELECTIVE INHIBITOR AND USE THEREOF 南京药石科技股份有限公司 2022-04-28 WO disclosed