SCHEMBL3487567

SCHEMBL3487567

Cc1cc(Oc2ccc(N)c(N(C)C(=O)O)c2)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.39
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
KCNH2 Q12809 1/20 0.36
PPARG P37231 2/20 0.35
NR4A1 P22736 1/20 0.34
GCK P35557 3/20 0.33
BTK Q06187 1/20 0.33
BRAF P15056 2/20 0.33
HDAC1 Q13547 2/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
SOS1 Q07889 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32

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
SCHEMBL3487710 0.90 MRGPRX4 (0.38) PPARGNR4A1GCKBTKBRAF
SCHEMBL3488808 0.89 SOS1 (0.42) HTR2ASLC6A4PPARGNR4A1BTK
SCHEMBL3488405 0.88 TDP1 (0.42) CHEK2HTR2ASLC6A4NR4A1HSD17B1
SCHEMBL3487420 0.86 SOS1 (0.46) CHEK2HTR2ASLC6A4KCNH2PPARG
SCHEMBL6544836 0.85 THRB (0.38) NR4A1HSD17B1HSD17B2
SCHEMBL3488333 0.85 BRAF (0.44) GCKBRAFHDAC1SOS1
SCHEMBL27804076 0.84 ABL1 (0.36) CHEK2HTR2ASLC6A4KCNH2PPARG
SCHEMBL3488271 0.84 VEGFA (0.40) PPARGNR4A1GCKBRAFHDAC1
SCHEMBL3487253 0.84 PPARG (0.38) SLC6A4PPARGGCKHSD17B1HSD17B2
SCHEMBL3488177 0.83 HSD17B1 (0.44) NR4A1BRAFHDAC1HSD17B1HSD17B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2138484-B1 FUSED BICYCLIC HETEROARYL DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2015-08-26 EP disclosed
US-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-02-25 US disclosed
EP-2138484-A1 FUSED BICYCLIC HETEROARYL DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-12-30 EP 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-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE PPARG, GPR119, PPARA CHEK2 3744/4885HTR2A 1485/4885SLC6A4 1449/4885

“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.