SCHEMBL29959449

SCHEMBL29959449

NC(=O)c1ncc(F)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.37
TSHR P16473 1/20 0.37
MC4R P32245 1/20 0.37
ADRA1A P35348 1/20 0.37
MC3R P41968 1/20 0.37
HPGDS O60760 1/20 0.36
PARP1 P09874 3/20 0.35
SIRT6 Q8N6T7 2/20 0.35
NNMT P40261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.35
AGBL2 Q5U5Z8 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
STAT3 P40763 1/20 0.33
JAK3 P52333 1/20 0.33
APLNR P35414 1/20 0.32
KCNN4 O15554 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL3625940 0.79 HPGDS (0.44) HPGDSPARP1JAK3MAP4K4CHEK2
SCHEMBL27961422 0.79 MAP4K4 (0.45) HPGDSMAP4K4CHEK2
SCHEMBL10328694 0.77 HCAR2 (0.41) AGBL2APLNR
SCHEMBL12970650 0.77 NNMT (0.41) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL24143680 0.75 IDO1 (0.30)
SCHEMBL1855352 0.75 KDM4E (0.40) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL217899 0.75 AGBL2 (0.37) SMN1; SMN2AGBL2APLNRALDH1A1MAOB
SCHEMBL5047396 0.75 APLNR (0.48) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL3172153 0.75 SIRT6 (0.45) ADORA3TSHRMC4RADRA1AMC3R
SCHEMBL4852706 0.75 APLNR (0.36) SIRT6SMN1; SMN2AGBL2APLNRALDH1A1

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-20240308979-A1 PROTEIN KINASE C INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2024-09-19 US disclosed
US-11505541-B2 Protein kinase C inhibitors and methods of their use NOVARTIS AG (CH) 2022-11-22 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 (2 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-20240308979-A1 PROTEIN KINASE C INHIBITORS AND METHODS OF THEIR USE PRKCA, PRKCB, PRKCH ADORA3 2839/4885TSHR 1987/4885MC4R 1784/4885
US-11505541-B2 Protein kinase C inhibitors and methods of their use PRKCA, PRKCB, PRKCH ADORA3 2839/4885TSHR 1987/4885MC4R 1784/4885

“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.