SCHEMBL6061576

SCHEMBL6061576

COCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(-c2cccc(S(=O)(=O)N3CCCCC3)c2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 2/20 0.39
MAPK8 P45983 2/20 0.38
MAPK9 P45984 2/20 0.38
MAPK10 P53779 1/20 0.38
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL5545610 0.93 MAPT (0.39) MAPTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL15163569 0.92 HSD17B10 (0.46) MAPTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL5545543 0.91 MAPT (0.40) MAPTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL5548024 0.87 SMN1; SMN2 (0.38) MAPTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL5548055 0.86 HPGD (0.46) MAPTALDH1A1LMNAHSD17B10GAA
SCHEMBL5545627 0.84 GRIN2B (0.40) MAPTALDH1A1LMNAGAA
SCHEMBL5547146 0.82 MAPK14 (0.41) MAPTSMN1; SMN2ALDH1A1LMNAGAA
SCHEMBL5546501 0.80 EGLN1 (0.41) MAPTSMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL5540839 0.80 EGLN1 (0.40) MAPTALDH1A1MAPK8HSD17B10THRB
SCHEMBL5545413 0.79 L3MBTL1 (0.36) LMNARAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150225399-A1 HIV INTEGRASE INHIBITORS VIIV HEALTHCARE CO (US) 2015-08-13 US disclosed
US-20140256713-A1 2-OXONAPHTHYRIDINE-3-CARBOXAMIDES HIV INTEGRASE INHIBITORS SHIONOGI & CO., LTD. (JP) 2014-09-11 US disclosed
EP-1720856-B1 HIV INTEGRASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-08-14 EP disclosed
EP-1720856-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2006-11-15 EP disclosed
WO-2005077050-A2 HIV INTEGRASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-08-25 WO 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-20140256713-A1 2-OXONAPHTHYRIDINE-3-CARBOXAMIDES HIV INTEGRASE INHIBITORS BCDIN3D, DUT, SAMHD1 MAPT 2173/4885SMN1; SMN2 4504/4885ALDH1A1 3812/4885
US-20150225399-A1 HIV INTEGRASE INHIBITORS ING2, API5, SAMHD1 MAPT 949/4885SMN1; SMN2 4786/4885ALDH1A1 3073/4885

“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.