SCHEMBL4296500

SCHEMBL4296500

O=C(O)c1cn(-c2ccccc2)nc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH1 Q13686 3/20 0.52
ALDH1A1 P00352 5/20 0.51
HPGD P15428 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
L3MBTL1 Q9Y468 3/20 0.48
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ATM Q13315 1/20 0.47
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
USP2 O75604 2/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MDM2 Q00987 1/20 0.43

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
SCHEMBL27852658 0.86 MRGPRX4 (0.47) ALKBH1ALDH1A1HPGDNPSR1L3MBTL1
SCHEMBL720149 0.84 NPSR1 (0.58) ALKBH1ALDH1A1HPGDNPSR1L3MBTL1
SCHEMBL3260509 0.84 L3MBTL1 (0.51) ALDH1A1HPGDNPSR1L3MBTL1KDM4E
SCHEMBL4703265 0.82 ALKBH1 (0.51) ALKBH1ALDH1A1HPGDLMNAMEN1
SCHEMBL5406901 0.81 KDM4E (0.57) ALDH1A1HPGDNPSR1KDM4EHSD17B10
SCHEMBL4302539 0.79 L3MBTL1 (0.62) ALDH1A1HPGDL3MBTL1KDM4EHSD17B10
SCHEMBL6218409 0.79 PTPN1 (0.48) ALKBH1ALDH1A1HPGDNPSR1PTGS1
SCHEMBL4847074 0.78 ALDH1A1 (0.54) ALDH1A1HPGDNPSR1KDM4EHSD17B10
SCHEMBL5411015 0.78 MEN1 (0.57) ALDH1A1NPSR1KDM4ESMN1; SMN2PTGS1
SCHEMBL5395054 0.78 ALDH1A1 (0.51) ALKBH1ALDH1A1HPGDNPSR1L3MBTL1

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-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 US disclosed
US-20090286791-A1 Amide Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-19 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-20090286791-A1 Amide Compounds DLAT, DGAT2, DGAT1 ALKBH1 2251/4885ALDH1A1 231/4885HPGD 1195/4885

“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.