SCHEMBL16378282

SCHEMBL16378282

NC(=O)c1cn(-c2ncccn2)nc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 15/20 0.40
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PARP1 P09874 2/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL4296493 0.86 DGAT1 (0.42) DGAT1ELANE
SCHEMBL13971692 0.85 DGAT1 (0.43) DGAT1L3MBTL1
SCHEMBL26796498 0.81 DGAT1 (0.41) DGAT1
SCHEMBL14307992 0.79 PARP1 (0.54) DGAT1L3MBTL1KDM4EPARP1
SCHEMBL13972035 0.78 DGAT1 (0.37) DGAT1ELANE
SCHEMBL4303943 0.78 KDM4E (0.49) DGAT1KDM4E
SCHEMBL3723418 0.77 DGAT1 (0.35) DGAT1KDM4EPARP1
SCHEMBL3724057 0.76 POLB (0.35) DGAT1L3MBTL1KDM4E
SCHEMBL3748782 0.74 DGAT1 (0.54) DGAT1
SCHEMBL3754178 0.73 HSD11B1 (0.47) DGAT1

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-9133204-B2 5-membered heterocyclic amides and related compounds H. LUNDBECK A/S (DK) 2015-09-15 US disclosed
US-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds MINDIMMUNE THERAPEUTICS, INC. 2015-01-01 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-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds GPR35, HCAR2, HCAR1 DGAT1 3593/4885L3MBTL1 4052/4885KDM4E 3311/4885

“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.