SCHEMBL15410871

SCHEMBL15410871

O=C(Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F)c1cc(Cl)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.51
▸ TMPRSS4 Q9NRS4 11/20 0.50
▸ P2RX1 P51575 6/20 0.46
▸ P2RX4 Q99571 5/20 0.46
▸ P2RX7 Q99572 5/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ IKBKB O14920 1/20 0.46
▸ CHUK O15111 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ MYLK Q15746 1/20 0.46
▸ MAP4K5 Q9Y4K4 1/20 0.46
▸ KCNMA1 Q12791 1/20 0.44
▸ ANO1 Q5XXA6 1/20 0.43
▸ SLC2A1 P11166 1/20 0.43
▸ TAS1R3 Q7RTX0 1/20 0.43
▸ TAS1R1 Q7RTX1 1/20 0.43
▸ TAS1R2 Q8TE23 1/20 0.43
▸ GRM5 P41594 1/20 0.43

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
SCHEMBL15410865 0.90 CYP11B2 (0.49) TLR8TMPRSS4P2RX1P2RX4P2RX7
SCHEMBL15410528 0.84 P2RX1 (0.45) TLR8TMPRSS4P2RX1MEN1KDR
SCHEMBL15410029 0.82 RXFP1 (0.40) TLR8MEN1KMT2A
SCHEMBL15410721 0.81 MEN1 (0.56) TLR8MEN1KMT2A
SCHEMBL15409614 0.81 RAB9A (0.52) MEN1KMT2AKCNMA1KDM4E
SCHEMBL15411772 0.79 TLR7 (0.38) TLR8TMPRSS4MEN1KMT2A
SCHEMBL15411818 0.79 TLR8 (0.41) TLR8TMPRSS4P2RX1MEN1KMT2A
SCHEMBL15411037 0.79 ABCC9 (0.52) MEN1KMT2AKCNMA1GRM5
SCHEMBL15411820 0.78 KDM4E (0.52) MEN1KMT2AKDM4E
SCHEMBL15411337 0.76 NPC1 (0.53) TMPRSS4MEN1KDRKMT2A

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-20140018566-A1 PALLADIUM(II)-CATALYZED SELECTIVE FLUORINATION OF BENZOIC ACIDS AND DERIVATIVES THE SCRIPPS RESEARCH INSTITUTE (US) 2014-01-16 — — 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-20140018566-A1 PALLADIUM(II)-CATALYZED SELECTIVE FLUORINATION OF BENZOIC ACIDS AND DERIVATIVES AHR, DDT, AOC2 TLR8 4122/4885TMPRSS4 4511/4885P2RX1 2449/4885

“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.

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