SCHEMBL3516169

SCHEMBL3516169

CC(=O)Nc1cc(=O)n(OCc2ccccc2)c2ncccc12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.48
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PPIA P62937 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40
TP53 P04637 2/20 0.39
ALOX15 P16050 1/20 0.39
GPR35 Q9HC97 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 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
SCHEMBL3515840 0.83 SMN1; SMN2 (0.40) MEN1KMT2APPIASMN1; SMN2MAPT
SCHEMBL3515597 0.81 ALDH1A1 (0.42) MEN1KMT2ASMN1; SMN2MAPTTP53
SCHEMBL3515379 0.80 KDM4E (0.45) MEN1KMT2ASMN1; SMN2MAPTTP53
SCHEMBL3514631 0.78 ALDH1A1 (0.41) MEN1KMT2ASMN1; SMN2MAPTTP53
SCHEMBL3517696 0.77 ALDH1A1 (0.40) BRD4MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL3519112 0.76 MEN1 (0.54) MEN1KMT2AATMTP53ALOX15
SCHEMBL3519104 0.75 ALDH1A1 (0.39) MEN1KMT2AALDH1A1TSHR
SCHEMBL3519074 0.74 PIK3CD (0.44) MEN1KMT2ASMN1; SMN2MAPTTP53
SCHEMBL3514876 0.73 CNR2 (0.44) MEN1KMT2ASMN1; SMN2MAPTTP53
SCHEMBL16238692 0.72 CNR2 (0.46) MEN1KMT2AMAPTTP53ALDH1A1

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 BRD4 2682/4885MEN1 3126/4885KMT2A 2764/4885

“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.