SCHEMBL9757674

SCHEMBL9757674

O=C(O)c1cn(C2CC2)c2cc(N3Cc4ccc(Cl)cc4C3)c(F)cc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 7/20 0.67
PIK3CD O00329 5/20 0.67
PIK3R1 P27986 5/20 0.67
PIK3CA P42336 5/20 0.67
KDM4E B2RXH2 4/20 0.63
ALDH1A1 P00352 4/20 0.63
LMNA P02545 3/20 0.63
HPGD P15428 2/20 0.63
HSD17B10 Q99714 2/20 0.63
CYP1A2 P05177 1/20 0.63
TOP2A P11388 1/20 0.63
CYP2C9 P11712 1/20 0.63
TOP2B Q02880 1/20 0.63
MAPT P10636 1/20 0.60
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HRH3 Q9Y5N1 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50

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
SCHEMBL9757383 0.89 KDM4E (0.69) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
Hydrochloric Acid SCHEMBL9757445 0.85 KDM4E (0.59) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL4632270 0.85 PIK3CG (0.72) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9757398 0.84 KDM4E (0.59) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9316448 0.84 KDM4E (0.62) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9757492 0.83 KDM4E (0.63) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9757402 0.82 KDM4E (0.59) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9757498 0.82 TOP2A (0.56) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9757673 0.82 PIK3CG (0.63) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E
SCHEMBL9316471 0.81 PIK3CG (0.65) PIK3CGPIK3CDPIK3R1PIK3CAKDM4E

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
US-5026856-A Bactericides WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1991-06-25 US disclosed
EP-0343560-A2 Isoindoline derivative WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1989-11-29 EP disclosed