SCHEMBL19829031

SCHEMBL19829031

CCCC1CCOC1CCC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.40
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
ADRA2A P08913 2/20 0.31
ADRA2B P18089 2/20 0.31
ADRA2C P18825 2/20 0.31
ADRA1A P35348 1/20 0.31

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
SCHEMBL8791552 0.80 EPHX1 (0.55) EPHX1
SCHEMBL28227694 0.79 EPHX1 (0.59) EPHX1
SCHEMBL28227693 0.79 EPHX1 (0.59) EPHX1
SCHEMBL14374937 0.76
SCHEMBL10202271 0.76
SCHEMBL24115804 0.76
SCHEMBL4356819 0.74
SCHEMBL16827243 0.74
SCHEMBL5797801 0.74 EPHX1 (0.48) EPHX1CA1CA2CA4ADRA2A
SCHEMBL29754642 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10556858-B2 Antioxidant inflammation modulators: oleanolic acid derivatives with amino and other modifications at C-17 REATA PHARMACEUTICALS, INC. (US) 2020-02-11 US disclosed
US-20190119202-A1 ANTIOXIDANT INFLAMMATION MODULATORS: OLEANOLIC ACID DERIVATIVES WITH AMINO AND OTHER MODIFICATIONS AT C-17 REATA PHARMACEUTICALS, INC. 2019-04-25 US disclosed
US-20180028553-A1 USE OF STING AGONIST AS CANCER TREATMENT THE UNIVERSITY OF CHICAGO 2018-02-01 US 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 (3 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-20180028553-A1 USE OF STING AGONIST AS CANCER TREATMENT STING1, IRF3, IFNAR1 EPHX1 2870/4885CA1 4875/4885CA2 4720/4885
US-20190119202-A1 ANTIOXIDANT INFLAMMATION MODULATORS: OLEANOLIC ACID DERIVATIVES WITH AMINO AND OTHER MODIFICATIONS AT C-17 IL17A, ALOX15, ALOX12 EPHX1 1518/4885CA1 3954/4885CA2 3897/4885
US-10556858-B2 Antioxidant inflammation modulators: oleanolic acid derivatives with amino and other modifications at C-17 IL17A, ALOX15, ALOX12 EPHX1 1518/4885CA1 3954/4885CA2 3897/4885

“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.