SCHEMBL3667769

SCHEMBL3667769

Cc1ccc(Nc2cnc(-c3ccccc3Cl)nc2)c(C(=O)O)c1.Cc1ccc(Nc2cnc(-c3ccccc3Cl)nc2)c(C(=O)OC(C)(C)C)c1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 19/20 0.81
FABP3 P05413 1/20 0.46
FABP4 P15090 1/20 0.46

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
SCHEMBL2407796 0.96 DHODH (0.74) DHODHFABP3FABP4
SCHEMBL468472 0.90 DHODH (1.00) DHODHFABP3FABP4
SCHEMBL2404053 0.89 DHODH (0.82) DHODH
SCHEMBL2404587 0.89 DHODH (0.63) DHODH
SCHEMBL3670177 0.88 DHODH (0.82) DHODH
SCHEMBL2403928 0.85 DHODH (0.74) DHODH
SCHEMBL2404343 0.84 DHODH (0.57) DHODH
SCHEMBL2405939 0.84 DHODH (0.75) DHODH
SCHEMBL2404076 0.83 DHODH (0.59) DHODH
SCHEMBL3665570 0.79 DHODH (0.82) DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210615-A1 Combinations comprising methotrexate and DHODH inhibitors Almirall, S.A. (ES) 2010-07-28 EP claimed
US-20140005178-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2014-01-02 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 (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-20140005178-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS DHODH, DPYD, DLD DHODH 1/4885FABP3 1260/4885FABP4 663/4885

“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.