SCHEMBL28062889

SCHEMBL28062889

CCC(=O)c1ccc2c(C(=O)O)c(C(F)(F)F)[nH]c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.38
ALOX15 P16050 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
FGFR1 P11362 1/20 0.36
FLT1 P17948 1/20 0.36
KDR P35968 1/20 0.36
PARP1 P09874 2/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
KIF11 P52732 1/20 0.36
RET P07949 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PLG P00747 1/20 0.35

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
SCHEMBL28062838 0.90 KDM4E (0.40) RAB9ASMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL28207487 0.85 KIF11 (0.43) RAB9ASMN1; SMN2KDM4EFGFR1FLT1
SCHEMBL28062758 0.78 HSD17B10 (0.43) RAB9ASMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL28207450 0.76 RAB9A (0.52) RAB9ASMN1; SMN2KDM4EALDH1A1FGFR1
SCHEMBL28207427 0.76 KDM4E (0.50) ALOX15KDM4EHPGDPARP1
SCHEMBL28207445 0.76 GPR17 (0.48) ALOX15SMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL28206987 0.74 KIF11 (0.47) RAB9ASMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL28207448 0.73 KIF11 (0.51) KDM4EGAAFGFR1KDRKIF11
SCHEMBL28062757 0.73 ALDH1A1 (0.42) RAB9ASMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL26250360 0.72 KDM4E (0.57) RAB9AKDM4EALDH1A1GAAHPGD

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-105646327-A 2-perfluoroalkyl indole derivative and synthesis method thereof 上海大学 2016-06-08 CN disclosed