SCHEMBL4630463

SCHEMBL4630463

CCN(Cc1ccccc1F)C(=O)CCc1ccc(OCc2ccccc2C(=O)OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.45
LPAR5 Q9H1C0 2/20 0.45
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FFAR1 O14842 6/20 0.43
FFAR4 Q5NUL3 6/20 0.43
MAOB P27338 3/20 0.43
SCN9A Q15858 1/20 0.42
SCN3A Q9NY46 1/20 0.42
TSPO P30536 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
CDC25B P30305 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL4629905 0.90 LPAR1 (0.46) LPAR1LPAR5MAOBSCN9ASCN3A
SCHEMBL4630536 0.90 LPAR1 (0.51) LPAR1LPAR5FFAR1FFAR4MAOB
SCHEMBL5316248 0.89 LPAR1 (0.41) LPAR1LPAR5MAPTFFAR1FFAR4
SCHEMBL3996243 0.88 TP53 (0.48) LPAR1LPAR5MAPTMAOBTSPO
SCHEMBL4764980 0.85 FFAR4 (0.43) POLBMAPTSMN1; SMN2FFAR1FFAR4
SCHEMBL4631046 0.83 PPARG (0.42) POLBMAPTSMN1; SMN2FFAR1FFAR4
SCHEMBL4001008 0.80 ALDH1A1 (0.46) POLBMAPTSMN1; SMN2FFAR1FFAR4
SCHEMBL4965244 0.80 MAPT (0.46) MAPTTSPONPC1
Amantadine SCHEMBL5311412 0.80 LPAR1 (0.42) LPAR1LPAR5FFAR1FFAR4MAOB
SCHEMBL4629897 0.80 LPAR1 (0.53) LPAR1LPAR5MAOBSCN9ASCN3A

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-1517883-B8 ORTHO-SUBSTITUTED BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF INSULIN RESISTANCE ASTRAZENECA AB (SE) 2008-05-21 EP disclosed
US-7355069-B2 Ortho-substituted benzoic acid derivatives for the treatment of insulin resistance ASTRAZENECA AB (SE) 2008-04-08 US disclosed
EP-1517883-B1 ORTHO-SUBSTITUTED BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF INSULIN RESISTANCE ASTRAZENECA AB (SE) 2008-02-13 EP disclosed
US-20050256198-A1 Ortho-substituted benzoic acid derivatives for the treatmetn of insulin resistance ASTRAZENECA AB (SE) 2005-11-17 US disclosed
EP-1517883-A1 ORTHO-SUBSTITUTED BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF INSULIN RESISTANCE AstraZeneca AB (SE) 2005-03-30 EP disclosed
WO-2004000790-A1 ORTHO-SUBSTITUTED BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF INSULIN RESISTANCE ASTRAZENECA AB (SE) 2003-12-31 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-20050256198-A1 Ortho-substituted benzoic acid derivatives for the treatmetn of insulin resistance GPR119, INSR, IRS1 LPAR1 2995/4885LPAR5 3941/4885POLB 2492/4885

“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.