SCHEMBL3519261

SCHEMBL3519261

CCOC(=O)CCC(=O)N(OCc1ccccc1)c1ncccc1C(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.54
TSHR P16473 2/20 0.48
CASP3 P42574 1/20 0.48
RAB9A P51151 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
PPIA P62937 2/20 0.47
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.45
HTT P42858 2/20 0.44
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HSP90AA1 P07900 1/20 0.41
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL1522806 0.90 L3MBTL1 (0.55) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL16236403 0.87 L3MBTL1 (0.54) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL3516526 0.86 L3MBTL1 (0.55) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL17181733 0.79 MAPT (0.45) L3MBTL1PPIAPOLBALDH1A1HTT
SCHEMBL6477382 0.75 KMT2A (0.54) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL3515297 0.74 L3MBTL1 (0.47) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL1522651 0.74 HSD17B10 (0.46) L3MBTL1TSHRRAB9AALDH1A1HTT
SCHEMBL3515081 0.74 L3MBTL1 (0.42) L3MBTL1TSHRCASP3RAB9ASENP8
SCHEMBL13435226 0.73 TSHR (0.45) L3MBTL1TSHRRAB9AALDH1A1SMN1; SMN2
SCHEMBL15846420 0.73 TSHR (0.48) L3MBTL1TSHRPPIAALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK SHARP & DOHME CORP. 2010-03-04 US disclosed
EP-2044068-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS Merck & Co., Inc. (US) 2009-04-08 EP disclosed
WO-2008010964-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK & CO., INC. (US) 2008-01-24 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 (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-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS RNASEH1, RNASE1, RNASEL L3MBTL1 2155/4885TSHR 3624/4885CASP3 2461/4885

“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.