SCHEMBL3515865

SCHEMBL3515865

CCOC(=O)c1c(-c2ccc(-c3ccc(CN)cc3)cc2)c2cccnc2n(OCc2ccccc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
GAA P10253 3/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 2/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
SLC11A2 P49281 1/20 0.38
PTGES O14684 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL3516366 0.89 MEN1 (0.41) MEN1KMT2ALMNASMN1; SMN2KDM4E
SCHEMBL3514518 0.84 MAOB (0.41) MEN1KMT2ALMNASMN1; SMN2KDM4E
SCHEMBL3519088 0.83 MEN1 (0.47) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL1522959 0.83 KDM4E (0.53) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL3515441 0.76 MEN1 (0.38) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL3517138 0.75 MEN1 (0.42) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL15847071 0.75 PTGDR2 (0.46) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL3517692 0.74 KDM4E (0.47) MEN1KMT2ALMNASMN1; SMN2KDM4E
SCHEMBL3517570 0.73 MEN1 (0.39) MEN1KMT2ALMNASMN1; SMN2KDM4E
SCHEMBL3518229 0.73 KDM4E (0.44) LMNASMN1; SMN2KDM4EALDH1A1HPGD

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 1 patent. 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

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 MEN1 3126/4885KMT2A 2764/4885LMNA 658/4885

“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.