SCHEMBL3515441

SCHEMBL3515441

CCOC(=O)c1c(-c2cc(-c3ccc(CN)cc3)cc(C(F)Cc3ccccc3)c2)c2cccnc2n(O)c1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.35
PABPC1 P11940 1/20 0.35
KLKB1 P03952 2/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ELANE P08246 3/20 0.33
MAOB P27338 1/20 0.33
ALOX5 P09917 1/20 0.33
MAPT P10636 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
TDP2 O95551 1/20 0.33
NSD2 O96028 1/20 0.33
PLCG1 P19174 1/20 0.33
PAX8 Q06710 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
SCHEMBL3514518 0.85 MAOB (0.41) MEN1KMT2ALMNASMN1; SMN2ELANE
SCHEMBL3515438 0.82 ADORA1 (0.34) MEN1KMT2ALMNASMN1; SMN2ELANE
SCHEMBL3515865 0.76 MEN1 (0.42) MEN1KMT2ALMNASMN1; SMN2MAOB
SCHEMBL3517570 0.74 MEN1 (0.39) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL3514327 0.74 MEN1 (0.40) MEN1KMT2ALMNASMN1; SMN2ELANE
SCHEMBL3517897 0.70 ALOX5 (0.41) ALOX5
SCHEMBL3518051 0.69 MEN1 (0.48) MEN1KMT2APOLBSMN1; SMN2ELANE
SCHEMBL3517498 0.69 ELANE (0.45) MEN1KMT2AELANEMAOB
SCHEMBL3519483 0.68 SMN1; SMN2 (0.47) MEN1KMT2ALMNASMN1; SMN2MAPT
SCHEMBL3514525 0.68 ALDH1A1 (0.55) MEN1KMT2ALMNASMN1; SMN2ELANE

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 2764/4885POLB 25/4885

“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.