SCHEMBL6250705

SCHEMBL6250705

FC(F)(F)c1ccc2nnc(-c3c(Cl)cccc3Cl)n2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 1.00
ALDH1A1 P00352 1/20 1.00
KDM4E B2RXH2 3/20 0.62
HSD17B10 Q99714 1/20 0.62
LMNA P02545 2/20 0.45
SCN5A Q14524 2/20 0.42
PIM1 P11309 4/20 0.40
LRRK2 Q5S007 1/20 0.40
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HSD11B1 P28845 1/20 0.39
TRPA1 O75762 3/20 0.38
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
P2RX7 Q99572 1/20 0.37

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
SCHEMBL6257917 0.92 SMN1; SMN2 (0.85) SMN1; SMN2ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL6264252 0.85 ALDH1A1 (0.73) SMN1; SMN2ALDH1A1KDM4EHSD17B10SCN5A
SCHEMBL15007056 0.80 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL11918906 0.73 KDM4E (0.56) SMN1; SMN2ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL12540237 0.70 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KDM4EHSD17B10SCN5A
SCHEMBL1189278 0.69 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KDM4EHSD17B10SCN5A
SCHEMBL15898868 0.69 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1KDM4EHSD17B10SCN5A
Bromide SCHEMBL1189112 0.68 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1KDM4EHSD17B10SCN5A
SCHEMBL15013681 0.68 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4EHSD17B10LMNA
SCHEMBL13757325 0.67 KDM4E (0.57) SMN1; SMN2ALDH1A1KDM4EHSD17B10LMNA

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
US-20050113283-A1 Methods of treating conditions associated with an EDG-4 receptor MANIV ENERGY CAPITAL 2005-05-26 US disclosed
EP-1513522-A2 METHODS OF TREATING CONDITIONS ASSOCIATED WITH AN EDG RECEPTOR SRI INTERNATIONAL (US) 2005-03-16 EP disclosed
WO-2003062392-A2 METHODS OF TREATING CONDITIONS ASSOCIATED WITH AN EDG RECEPTOR CERETEK LLC (US) 2003-07-31 WO 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-20050113283-A1 Methods of treating conditions associated with an EDG-4 receptor EDNRA, EDNRB, ESRRG SMN1; SMN2 2732/4885ALDH1A1 2855/4885KDM4E 2621/4885

“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.