SCHEMBL12828684

SCHEMBL12828684

Cc1cccc(COc2cc(-c3ccc(F)c(C(F)(F)F)c3)n3ncnc3c2C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 9/20 0.40
BRAF P15056 1/20 0.38
KMO O15229 1/20 0.37
RIPK1 Q13546 4/20 0.37
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
ANO1 Q5XXA6 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35

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
SCHEMBL8520790 0.91 RIPK1 (0.41) MRGPRX4KMORIPK1
SCHEMBL12828558 0.90 BRAF (0.38) MRGPRX4BRAFRIPK1MAPTLMNA
SCHEMBL8520796 0.83 NR1H2 (0.39) BRAFKMORIPK1
SCHEMBL8527906 0.81 RIPK1 (0.42) BRAFRIPK1TP53
SCHEMBL8520679 0.76 EGLN2 (0.43) EGLN1
SCHEMBL12935693 0.70 KMO (0.41) BRAFKMORIPK1
SCHEMBL12828249 0.69 BRAF (0.42) BRAFRIPK1
SCHEMBL6123299 0.69 EGLN1 (0.46) KMORIPK1EGLN1
Hydrochloric Acid SCHEMBL1484193 0.69 EGLN1 (0.46) KMORIPK1EGLN1
SCHEMBL8526969 0.68 EGLN2 (0.39) MRGPRX4MAPTTHRBFFAR4EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283465-B2 Triazolopyridine compound, and action thereof as prolyl hydroxylase inhibitor or erythropoietin production-inducing agent JAPAN TOBACCO INC. (JP) 2012-10-09 US disclosed
US-20110077267-A1 TRIAZOLOPYRIDINE COMPOUND, AND ACTION THEREOF AS PROLYL HYDROXYLASE INHIBITOR OR ERYTHROPOIETIN PRODUCTION-INDUCING AGENT JAPAN TOBACCO INC. (JP) 2011-03-31 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-20110077267-A1 TRIAZOLOPYRIDINE COMPOUND, AND ACTION THEREOF AS PROLYL HYDROXYLASE INHIBITOR OR ERYTHROPOIETIN PRODUCTION-INDUCING AGENT EGLN3, EPOR, EGLN2 MRGPRX4 2819/4885BRAF 1279/4885KMO 2380/4885

“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.