SCHEMBL1503089

SCHEMBL1503089

NC(=O)c1ccc(C(=O)NCO)nc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NNMT P40261 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAOB P27338 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 1/20 0.45
EGLN1 Q9GZT9 2/20 0.43
EPHX2 P34913 1/20 0.43
THRB P10828 1/20 0.42

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
SCHEMBL8824679 0.88 THRB (0.54) SMN1; SMN2MAOBKDM4ENPC1ALDH1A1
SCHEMBL840724 0.81 LOXL2 (0.50) NNMTSMN1; SMN2MAOBKDM4ENPC1
SCHEMBL2219738 0.81 NNMT (0.61) NNMTSMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL3668875 0.79 SCN9A (0.47) NNMTSMN1; SMN2MAOBEPHX2
SCHEMBL978974 0.78 NNMT (0.63) NNMTSMN1; SMN2KDM4E
SCHEMBL27189506 0.77 NNMT (0.57) NNMTSMN1; SMN2KDM4ENPC1ALDH1A1
Hydrochloric Acid SCHEMBL6485765 0.76 NNMT (0.61) NNMTSMN1; SMN2KDM4E
SCHEMBL10918143 0.76 EPHX2 (0.53) SMN1; SMN2MAOBKDM4ENPC1ALDH1A1
Hydrochloric Acid SCHEMBL7702795 0.76 NNMT (0.61) NNMTSMN1; SMN2KDM4E
SCHEMBL7660982 0.76 POLB (0.56) SMN1; SMN2MAOBKDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300433-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE Ambrilia Biopharma Inc. (CA) 2011-03-30 EP claimed
WO-2009146555-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA INC. (CA) 2009-12-10 WO claimed
US-11931348-B2 Methods of treating elevated plasma cholesterol Montréal Heart Institute (CA) 2024-03-19 US disclosed
US-20230088095-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL Montréal Heart Institute (CA) 2023-03-23 US disclosed
US-8742123-B2 HIV integrase inhibitors from pyridoxine TAIMED BIOLOGICS, INC. (TW) 2014-06-03 US disclosed
US-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA, INC. (CA) 2011-07-21 US disclosed
EP-2300433-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE Ambrilia Biopharma Inc. (CA) 2011-03-30 EP disclosed
WO-2009146555-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE AMBRILIA BIOPHARMA INC. (CA) 2009-12-10 WO 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 (3 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-20110178120-A1 HIV INTEGRASE INHIBITORS FROM PYRIDOXINE PNPO, CCNB1, BLVRB NNMT 483/4885SMN1; SMN2 3503/4885MAOB 40/4885
US-11931348-B2 Methods of treating elevated plasma cholesterol CETP, LDLR, APOB NNMT 2444/4885SMN1; SMN2 3911/4885MAOB 1830/4885
US-20230088095-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL CETP, LDLR, APOB NNMT 2444/4885SMN1; SMN2 3911/4885MAOB 1830/4885

“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.