SCHEMBL8735575

SCHEMBL8735575

CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCN(c4ncc(Cl)cn4)CC3)c(C(F)(F)F)c21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
HSD17B10 Q99714 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
PMP22 Q01453 1/20 0.50
LMNA P02545 3/20 0.48
CASP1 P29466 1/20 0.48
ENPP2 Q13822 6/20 0.47
DRD3 P35462 1/20 0.46
PIK3CG P48736 2/20 0.45
CYP2C9 P11712 1/20 0.44
ATP6V1B2 P21281 1/20 0.44
TBXA2R P21731 1/20 0.44
EDNRA P25101 1/20 0.44
TARBP2 Q15633 1/20 0.44
MAPK1 P28482 1/20 0.44
PIK3CD O00329 1/20 0.44
PIK3R1 P27986 1/20 0.44
PIK3CA P42336 1/20 0.44
BRD4 O60885 1/20 0.44

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
SCHEMBL8057366 0.90 KDM4E (0.53) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8064249 0.86 KDM4E (0.52) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8058551 0.86 KDM4E (0.48) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL10401508 0.86 KDM4E (0.68) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL10401471 0.83 KDM4E (0.63) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8059277 0.82 KDM4E (0.49) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8059291 0.82 KDM4E (0.62) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8058568 0.82 KDM4E (0.52) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8733910 0.80 KDM4E (0.55) KDM4EHSD17B10ALDH1A1HPGDPMP22
SCHEMBL8057426 0.80 KDM4E (0.51) KDM4EHSD17B10ALDH1A1HPGDPMP22

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
EP-0878194-A1 REMEDIES OR PREVENTIVES FOR AIDS SANKYO COMPANY LIMITED (JP) 1998-11-18 EP disclosed