SCHEMBL6245249

SCHEMBL6245249

O=C(O)C(=O)N(Cl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.46
ALDH1A1 P00352 7/20 0.43
HTT P42858 3/20 0.43
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 2/20 0.43
RAB9A P51151 2/20 0.43
GLA P06280 2/20 0.39
TSHR P16473 2/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
PAX8 Q06710 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 2/20 0.36
MEN1 O00255 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL3730131 0.80 NPSR1 (0.50) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL11115139 0.80 NPSR1 (0.56) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL5932378 0.78 NPSR1 (0.48) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL8397256 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL2724521 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL2724523 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL5932621 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL4201822 0.76 NPSR1 (0.52) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL5932609 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1
SCHEMBL3641338 0.76 NPSR1 (0.46) NPSR1ALDH1A1HTTKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242069-B1 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL INC (US) 2005-06-29 EP disclosed
US-6552077-B2 Kidney disorders EXOCELL, INC. 2003-04-22 US disclosed
EP-1242069-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2002-09-25 EP disclosed
US-6355680-B1 BLOCKING REACTION OF GLUCOSE AND ALBUMIN EXOCELL, INC. 2002-03-12 US disclosed
US-20010034359-A1 Albumin-binding compounds that prevent nonenzymatic glycation and that may be used for treatment of glycation-related pathologies EXOCELL, INC. 2001-10-25 US disclosed
WO-2001003684-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2001-01-18 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 (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-20010034359-A1 Albumin-binding compounds that prevent nonenzymatic glycation and that may be used for treatment of glycation-related pathologies ALB, AGER, TTR NPSR1 3711/4885ALDH1A1 942/4885HTT 613/4885

“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.