SCHEMBL27488200

SCHEMBL27488200

O=C(O)NC(Cc1ccccc1)C(=O)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.71
KDM4E B2RXH2 1/20 0.66
TP53 P04637 1/20 0.58
GFER P55789 2/20 0.56
ITGA4 P13612 1/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
GRM5 P41594 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
TSHR P16473 1/20 0.53
GLA P06280 1/20 0.52
HTT P42858 1/20 0.52
SLC6A7 Q99884 1/20 0.51
USP2 O75604 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 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
SCHEMBL6983547 0.85 KDM4E (0.63) POLBKDM4ETP53GFERMEN1
SCHEMBL6982668 0.84 POLB (0.60) POLBKDM4ETP53GFERITGA4
SCHEMBL8403402 0.82 GAA (0.55) POLBKDM4ETP53GFERKMT2A
SCHEMBL4772342 0.81 POLB (0.62) POLBKDM4ETP53GFERGRM5
Hydrochloric Acid SCHEMBL6980746 0.81 POLB (0.61) POLBKDM4ETP53GFERGRM5
SCHEMBL23244240 0.80 ALDH1A1 (0.62) POLBKDM4ETP53GFERMEN1
SCHEMBL23244242 0.80 ALDH1A1 (0.62) POLBKDM4ETP53GFERMEN1
SCHEMBL27146671 0.80 HSD17B10 (0.66) MEN1KMT2ASMN1; SMN2
SCHEMBL27146672 0.80 HSD17B10 (0.66) MEN1KMT2ASMN1; SMN2
SCHEMBL18049384 0.78 POLB (0.52) POLBKDM4EGFERITGA4MEN1

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-1163145-A Inhibiting agent for vascular formation SENJI SEIYAKU K K (JP) 1997-10-29 CN disclosed