SCHEMBL15053745

SCHEMBL15053745

[2H]C([2H])([2H])Oc1ccc(F)c(NC(=O)Nc2cccc3c2ccn3C([2H])([2H])c2c[nH]c3ncccc23)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.38
FGFR4 P22455 1/20 0.38
PDPK1 O15530 1/20 0.37
BRAF P15056 3/20 0.36
NTRK1 P04629 1/20 0.35
DGAT2 Q96PD7 1/20 0.34
MTNR1A P48039 1/20 0.34
DRD4 P21917 2/20 0.34
DRD3 P35462 2/20 0.34
ROCK1 Q13464 2/20 0.34
RIPK1 Q13546 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
PTGER3 P43115 1/20 0.33
DRD2 P14416 1/20 0.33

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
SCHEMBL15052964 0.95 FGFR1 (0.43) FGFR1FGFR4PDPK1BRAFNTRK1
SCHEMBL15053324 0.92 MEN1 (0.41) FGFR1FGFR4MTNR1AALDH1A1MEN1
SCHEMBL15052754 0.89 BRAF (0.38) BRAFROCK1ALDH1A1PTGER3FLT1
SCHEMBL15053488 0.89 FGFR1 (0.41) FGFR1FGFR4BRAFRIPK1ALDH1A1
SCHEMBL15053584 0.89 MAPT (0.42) FGFR1FGFR4BRAFNTRK1MTNR1A
SCHEMBL15053044 0.88 BRAF (0.43) PDPK1BRAFMTNR1AMEN1KMT2A
SCHEMBL3707113 0.88 FGFR1 (0.46) FGFR1FGFR4PDPK1DGAT2DRD4
SCHEMBL15053326 0.87 PDPK1 (0.39) FGFR1FGFR4PDPK1BRAFMTNR1A
Hydrochloric Acid SCHEMBL3697319 0.87 FGFR1 (0.46) FGFR1FGFR4PDPK1DGAT2DRD4
SCHEMBL15053897 0.87 MEN1 (0.48) FGFR1FGFR4ALDH1A1MEN1KMT2A

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-20130165475-A1 DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ASCEPION PHARMACEUTICALS, INC. (CN) 2013-06-27 US claimed
US-20130165475-A1 DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ASCEPION PHARMACEUTICALS, INC. (CN) 2013-06-27 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-20130165475-A1 DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS CDK2, CDK1, CDK3 FGFR1 956/4885FGFR4 1668/4885PDPK1 128/4885

“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.