SCHEMBL6477823

SCHEMBL6477823

O=C(O)c1cccc(OC2CCOC2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.50
POLB P06746 1/20 0.48
GRIK1 P39086 1/20 0.48
GRIA2 P42262 1/20 0.48
AKR1C3 P42330 1/20 0.47
GCK P35557 1/20 0.44
PDE4D Q08499 4/20 0.43
PDE4A P27815 3/20 0.43
PDE4B Q07343 3/20 0.43
PDE4C Q08493 3/20 0.43
OPRK1 P41145 2/20 0.43
KMT2A Q03164 1/20 0.42
NR4A2 P43354 1/20 0.42
CPT2 P23786 2/20 0.42
CPT1A P50416 2/20 0.42
KAT6A Q92794 1/20 0.42
ACACB O00763 1/20 0.42
ACACA Q13085 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
SCHEMBL30517690 1.00 EPHX2 (0.50) EPHX2POLBGRIK1GRIA2AKR1C3
SCHEMBL30567543 1.00 EPHX2 (0.50) EPHX2POLBGRIK1GRIA2AKR1C3
SCHEMBL29267960 1.00 EPHX2 (0.50) EPHX2POLBGRIK1GRIA2AKR1C3
SCHEMBL1168318 0.91 EPHX2 (0.55) EPHX2POLBGRIK1GRIA2AKR1C3
SCHEMBL30507908 0.91 EPHX2 (0.55) EPHX2POLBGRIK1GRIA2AKR1C3
SCHEMBL29440998 0.88 AKR1C3 (0.53) EPHX2GRIK1GRIA2AKR1C3OPRK1
SCHEMBL1377451 0.87 OPRK1 (0.57) OPRK1
SCHEMBL30567549 0.87 OPRK1 (0.57) OPRK1
SCHEMBL29505911 0.83 EPHX2 (0.65) EPHX2GRIK1GRIA2AKR1C3PDE4D
SCHEMBL28885485 0.83 POLB (0.45) POLBPDE4DPDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022146698-A1 SOS1 INHIBITORS AND USES THEREOF Revolution Medicines, Inc. (US) 2022-07-07 WO disclosed
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 EPHX2 1236/4885POLB 2378/4885GRIK1 3715/4885

“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.