SCHEMBL2081424

SCHEMBL2081424

CC(C)(C)C(=O)Nc1c(Cc2ccc(F)cc2F)ccnc1-c1c(F)cccc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ PIK3C3 Q8NEB9 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ ANO1 Q5XXA6 4/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SYK P43405 1/20 0.34
▸ MAPK14 Q16539 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ PLA2G1B P04054 1/20 0.33
▸ ATG4B Q9Y4P1 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ GRM4 Q14833 1/20 0.33
▸ ABL1 P00519 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
SCHEMBL4078010 0.80 MAPK14 (0.40) PIK3C3MAPTGSK3BMEN1KMT2A
SCHEMBL4070987 0.77 P2RY1 (0.33) SMN1; SMN2NPC1RAB9AMAPTGSK3B
SCHEMBL2825730 0.76 MAPK13 (0.38) MAPTGSK3BSYKMAPK14LMNA
SCHEMBL2079443 0.74 FPR2 (0.32) SMN1; SMN2NPC1RAB9AMAPTGSK3B
SCHEMBL13353994 0.72 CNR2 (0.33) SMN1; SMN2NPC1RAB9AMAPTGSK3B
SCHEMBL2076784 0.71 MAPK14 (0.42) MAPTMEN1KMT2ASYKMAPK14
SCHEMBL13321786 0.70 CCNT1 (0.34) MAPTANO1LMNAMAPK1
SCHEMBL2832374 0.69 RORB (0.41) SMN1; SMN2RAB9AMAPTGSK3BMEN1
SCHEMBL2829217 0.69 EGFR (0.39) MAPTMEN1KMT2AMAPK14LMNA
SCHEMBL2081557 0.67 CCNT1 (0.34) MAPTANO1MEN1KMT2AMAPK14

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-7906530-B2 1,7-naphthyridine derivatives as p38 MAP kinase inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2011-03-15 — — US disclosed
US-20100227881-A1 1,7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2010-09-09 — — 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-20100227881-A1 1,7-NAPHTHYRIDINE DERIVATIVES AS P38 MAP KINASE INHIBITORS MAPK1, MAPK7, MAPKAPK2 RIPK1 1561/4885SMN1; SMN2 1667/4885NPC1 1129/4885

“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.

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