SCHEMBL3000796

SCHEMBL3000796

FC(F)(F)Oc1ccc(-c2ccc3c(c2)c(Cl)c(-c2nnn[nH]2)n3-c2ccc(OC3CCCC3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 2/20 0.35
FPR2 P25090 2/20 0.34
PROKR1 Q8TCW9 2/20 0.34
CNR1 P21554 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4D Q08499 1/20 0.33
KCNH2 Q12809 3/20 0.33
HRH3 Q9Y5N1 3/20 0.32
EPHX2 P34913 2/20 0.32
ROCK2 O75116 2/20 0.32
JAK2 O60674 1/20 0.32
PRKD3 O94806 1/20 0.32
PRKCG P05129 1/20 0.32
PHKG2 P15735 1/20 0.32
RPS6KB1 P23443 1/20 0.32
MARK3 P27448 1/20 0.32
PRKCI P41743 1/20 0.32
CLK2 P49760 1/20 0.32
IRAK1 P51617 1/20 0.32
RPS6KA3 P51812 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
SCHEMBL3006194 0.97 MAP4K1 (0.36) MAP4K1FPR2PROKR1CNR1KCNH2
SCHEMBL3000984 0.84 MCHR1 (0.36) MAP4K1KCNH2HRH3PIM2MCHR1
SCHEMBL3009742 0.84 MAP4K1 (0.37) MAP4K1MCHR1SCN9APOLBL3MBTL1
SCHEMBL3011914 0.82 JAK2 (0.35) MAP4K1FPR2PROKR1PDE4BPDE4D
SCHEMBL3012453 0.75 PTGES (0.39) MAP4K1MCHR1
SCHEMBL3001788 0.75 POLB (0.34) MAP4K1MCHR1POLBL3MBTL1
SCHEMBL3003503 0.73 PRMT5 (0.34) MAP4K1PDE4BPDE4DKCNH2HRH3
SCHEMBL21275530 0.67 BTK (0.43) KCNH2HRH3
SCHEMBL4922516 0.67 EPHX2 (0.44) PDE4BPDE4DEPHX2FAAH
SCHEMBL3015385 0.67 PPARG (0.33) SCN9A

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-20100197687-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-08-05 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-20100197687-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, TPH1 MAP4K1 293/4885FPR2 120/4885PROKR1 651/4885

“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.