SCHEMBL5060744

SCHEMBL5060744

O=C(Nc1ccccc1C(=O)O)OCc1ccc2c(c1)OCCO2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.54
ALDH1A1 P00352 6/20 0.54
RAB9A P51151 5/20 0.54
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 2/20 0.54
TSHR P16473 2/20 0.54
ATM Q13315 1/20 0.54
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.48
CYP3A4 P08684 1/20 0.47
HTT P42858 2/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
FAAH O00519 2/20 0.44
NAAA Q02083 1/20 0.44
CA12 O43570 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
SCHEMBL2233522 0.79 NPC1 (0.69) NPC1ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL589813 0.78 NPC1 (0.85) NPC1ALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL5055502 0.77 NPC1 (0.58) NPC1ALDH1A1RAB9ANAAAMGLL
SCHEMBL22497489 0.76 KDM4E (0.61) NPC1ALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL8541015 0.75 PPARG (0.51) NPC1ALDH1A1RAB9ATSHRCYP3A4
SCHEMBL22497553 0.75 RAB9A (0.52) NPC1ALDH1A1RAB9AKDM4EMEN1
SCHEMBL14441238 0.74 HCAR2 (0.62) NPC1ALDH1A1RAB9ATSHRKDM4E
SCHEMBL18101229 0.74 CYP3A4 (0.52) NPC1ALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL18101287 0.74 CYP3A4 (0.52) NPC1ALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL18101227 0.74 CYP3A4 (0.52) NPC1ALDH1A1RAB9AMAPTSMN1; SMN2

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
US-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia SMITHKLINE BEECHAM CORPORATION 2008-06-12 US claimed
US-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia SMITHKLINE BEECHAM CORPORATION 2008-06-12 US disclosed
US-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia SMITHKLINE BEECHAM CORPORATION 2008-06-12 US disclosed
US-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia SMITHKLINE BEECHAM CORPORATION 2008-06-12 US disclosed
EP-1848707-A1 AWTHRANILIC ACID DERIVATIVES AND THEIR USE IN TREATMENT OF DISEASES OF LIPID METABOLISM, IN PARTICULAR DYSLIPIDAEMIA SMITHKLINE BEECHAM CORPORATION (US) 2007-10-31 EP disclosed
WO-2006085108-A1 AWTHRANILIC ACID DERIVATIVES AND THEIR USE IN TREATMENT OF DISEASES OF LIPID METABOLISM, IN PARTICULAR DYSLIPIDAEMIA SMITHKLINE BEECHAM CORPORATION (US) 2006-08-17 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-20080139565-A1 Anthranilic Acid Derivatives and Their Use in Treatment of Diseases of Lipid Metabolism, in Particular Dyslipidaemia ANTXR2, CYP46A1, HCAR1 NPC1 961/4885ALDH1A1 1540/4885RAB9A 1041/4885

“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.