SCHEMBL4580266

SCHEMBL4580266

O=C(NCc1ccco1)c1ccc2cncc(Nc3cccc(C(F)(F)F)c3)c2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.53
CNR2 P34972 1/20 0.45
ALDH1A1 P00352 7/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
HPGD P15428 5/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 7/20 0.43
HSD17B10 Q99714 4/20 0.42
MAPT P10636 4/20 0.42
USP2 O75604 3/20 0.42
CASP1 P29466 3/20 0.42
CASP7 P55210 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL4580584 0.90 GAA (0.48) POLBCNR2ALDH1A1KMT2AMEN1
SCHEMBL4579023 0.86 ALDH1A1 (0.50) POLBCNR2ALDH1A1KMT2AMEN1
SCHEMBL4581576 0.83 ALDH1A1 (0.53) POLBCNR2ALDH1A1KMT2AMEN1
SCHEMBL4580503 0.83 ALDH1A1 (0.52) POLBCNR2ALDH1A1KMT2AMEN1
SCHEMBL14394250 0.82 HDAC3 (0.38) POLBCNR2KMT2AMEN1LMNA
SCHEMBL4580889 0.82 MAPT (0.59) POLBALDH1A1KMT2AMEN1TDP1
SCHEMBL5183236 0.80 MPO (0.50) ALDH1A1KMT2AMEN1TDP1LMNA
SCHEMBL4581518 0.79 MAPT (0.61) POLBALDH1A1KMT2AMEN1TDP1
SCHEMBL4581196 0.77 ALDH1A1 (0.60) POLBCNR2ALDH1A1KMT2AMEN1
SCHEMBL14266821 0.75 ALDH1A1 (0.55) POLBALDH1A1KMT2AMEN1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives SERENEX, INC. 2008-02-07 US claimed
US-7282506-B2 2,8-disubstituted naphthyridine derivatives SERENEX, INC. (US) 2007-10-16 US claimed
EP-1773834-A2 2, 8-DISUBSTITUTED NAPHTHYRIDINE DERIVATIVES Serenex, Inc. (US) 2007-04-18 EP claimed
WO-2006017672-A2 2, 8-DISUBSTITUTED NAPHTHYRIDINE DERIVATIVES SERENEX INC. (US) 2006-02-16 WO claimed
US-20060030584-A1 2,8-Disubstituted naphthyridine derivatives SERENEX, INC. 2006-02-09 US claimed
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives SERENEX, INC. 2008-02-07 US disclosed
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives SERENEX, INC. 2008-02-07 US disclosed
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives SERENEX, INC. 2008-02-07 US disclosed
US-7282506-B2 2,8-disubstituted naphthyridine derivatives SERENEX, INC. (US) 2007-10-16 US disclosed
US-7282506-B2 2,8-disubstituted naphthyridine derivatives SERENEX, INC. (US) 2007-10-16 US disclosed
US-20060030584-A1 2,8-Disubstituted naphthyridine derivatives SERENEX, INC. 2006-02-09 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 (2 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-20060030584-A1 2,8-Disubstituted naphthyridine derivatives CCNA1, FOXM1, CCNA2 POLB 2026/4885CNR2 189/4885ALDH1A1 107/4885
US-20080032991-A1 2, 8-disubstituted Naphthyridine Derivatives CCNA1, FOXM1, CCNA2 POLB 2026/4885CNR2 189/4885ALDH1A1 107/4885

“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.