SCHEMBL6477259

SCHEMBL6477259

CN1CCC(Oc2cccc(C(=O)O)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 2/20 0.54
EPHX2 P34913 2/20 0.53
SLC5A7 Q9GZV3 2/20 0.53
HRH1 P35367 1/20 0.50
CCR3 P51677 1/20 0.50
RAB9A P51151 2/20 0.49
WNT1 P04628 1/20 0.48
GSK3B P49841 1/20 0.48
DYRK1A Q13627 1/20 0.48
GRIK1 P39086 1/20 0.48
GRIA2 P42262 1/20 0.48
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL18871751 0.87 OPRK1 (0.69) OPRK1
SCHEMBL29505911 0.86 EPHX2 (0.65) OPRK1KMT2AMEN1EPHX2HRH1
Hydrochloric Acid SCHEMBL4492052 0.86 OPRK1 (0.67) OPRK1
SCHEMBL17339942 0.86 KMT2A (0.54) OPRK1KMT2AMEN1EPHX2SLC5A7
SCHEMBL4664688 0.85 SLC5A7 (0.58) OPRK1KMT2AMEN1SLC5A7CCR3
SCHEMBL4237314 0.85 HRH3 (0.57) OPRK1KMT2AMEN1EPHX2SLC5A7
SCHEMBL17573006 0.84 EPHX2 (0.52) OPRK1KMT2AMEN1EPHX2SLC5A7
Hydrochloric Acid SCHEMBL7081383 0.84 HRH3 (0.56) OPRK1KMT2AMEN1EPHX2SLC5A7
SCHEMBL930213 0.83 EPHX2 (0.59) OPRK1KMT2AMEN1EPHX2RAB9A
SCHEMBL931435 0.83 EPHX2 (0.59) OPRK1KMT2AMEN1EPHX2GRIK1

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-6956037-B2 Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRAZENECA AB (SE) 2005-10-18 US disclosed
EP-1077931-B1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2004-11-17 EP disclosed
US-20030212068-A1 Benzamide derivatives for the treatment of diseases mediated by cytokines ASTRAZENECA AB 2003-11-13 US disclosed
US-6579872-B1 Such as TNF, in particular of TNF alpha, and various interleukins, in particular IL-1; N-(5-(4-(3-hydroxypropoxy)benzamido)-2-methylphenyl)-3,4-dimethoxybenzamide ASTRAZENECA AB (SE) 2003-06-17 US disclosed
EP-1077931-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-1999059959-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 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-20030212068-A1 Benzamide derivatives for the treatment of diseases mediated by cytokines IL2, IL6, IL6ST OPRK1 924/4885KMT2A 2107/4885MEN1 3698/4885

“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.