SCHEMBL18080342

SCHEMBL18080342

Cc1c(F)c(C(C)C)c[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
DAO P14920 1/20 0.31
CHEK1 O14757 1/20 0.30
AURKA O14965 1/20 0.30
MAP4K4 O95819 1/20 0.30
ABL1 P00519 1/20 0.30
CSF1R P07333 1/20 0.30
RET P07949 1/20 0.30
MET P08581 1/20 0.30
FGFR1 P11362 1/20 0.30
PDGFRA P16234 1/20 0.30
FLT1 P17948 1/20 0.30
LTK P29376 1/20 0.30
GRK5 P34947 1/20 0.30
CSNK1A1 P48729 1/20 0.30
CDK8 P49336 1/20 0.30
CLK2 P49760 1/20 0.30
CDK7 P50613 1/20 0.30
CDK9 P50750 1/20 0.30
NEK2 P51955 1/20 0.30

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
SCHEMBL18081718 0.74 ATAD2 (0.43) KDM4EDAO
SCHEMBL26276532 0.71 AR (0.33) DAOCHEK1AURKAMAP4K4ABL1
SCHEMBL15468987 0.69 CHEK1 (0.38) DAOCHEK1AURKAMAP4K4ABL1
SCHEMBL23488021 0.67 DAO (0.52) KDM4EDAOCHEK1AURKAMAP4K4
SCHEMBL29480992 0.66 PARP1 (0.42) KDM4EDAO
SCHEMBL27294644 0.66 ATAD2 (0.43) KDM4EDAO
SCHEMBL24823617 0.65 EIF4A3 (0.36) DAOCHEK1AURKAMAP4K4ABL1
SCHEMBL18080339 0.65 EIF4A3 (0.37) CHEK1AURKAMAP4K4ABL1CSF1R
SCHEMBL23890466 0.65
SCHEMBL22167734 0.65

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
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 KDM4E 4689/4885DAO 2447/4885CHEK1 1939/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.