SCHEMBL3515322

SCHEMBL3515322

CCOC(=O)c1c(O)c2cc(C(=O)NC3CCCCC3)cnc2n(O)c1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
RECQL P46063 1/20 0.45
PDE4B Q07343 2/20 0.44
CNR2 P34972 2/20 0.43
RAB9A P51151 4/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGDS O60760 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CNR1 P21554 1/20 0.41
NPC1 O15118 2/20 0.40
GAA P10253 2/20 0.40
PPARG P37231 1/20 0.40
NCOA2 Q15596 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL14313881 0.83 RECQL (0.43) ALDH1A1RECQLPDE4BRAB9AHPGD
SCHEMBL3517521 0.82 ALDH1A1 (0.44) ALDH1A1RECQLHPGDSMN1; SMN2KDM4E
SCHEMBL3517034 0.79 KDM4E (0.47) ALDH1A1RECQLRAB9AHPGDSMN1; SMN2
SCHEMBL3517790 0.78 MAPT (0.48) ALDH1A1RECQLRAB9ASMN1; SMN2KDM4E
SCHEMBL3517786 0.76 ALDH1A1 (0.52) ALDH1A1RECQLCNR2SMN1; SMN2KDM4E
SCHEMBL3517893 0.76 KDM4E (0.42) ALDH1A1RECQLPDE4BRAB9ASMN1; SMN2
SCHEMBL13435288 0.75 P2RY12 (0.52) ALDH1A1HPGDSMN1; SMN2KDM4ENPC1
SCHEMBL13435287 0.74 ROCK2 (0.50) HPGDSMN1; SMN2HPGDS
SCHEMBL3515732 0.74 GRM5 (0.39) RECQLRAB9AKDM4ENPC1
SCHEMBL3517888 0.74 ALDH1A1 (0.42) ALDH1A1RECQLHPGDSMN1; SMN2KDM4E

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
US-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK SHARP & DOHME CORP. 2010-03-04 US disclosed
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 ALDH1A1 1486/4885RECQL 11/4885PDE4B 2072/4885

“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.