SCHEMBL2403767

SCHEMBL2403767

O=C(O)c1cc(Cl)ccc1Nc1ccc(Br)nc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 11/20 0.65
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
USP2 O75604 1/20 0.57
PABPC1 P11940 1/20 0.57
AKR1C3 P42330 2/20 0.51
AKR1C2 P52895 2/20 0.51
POLB P06746 2/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
MPO P05164 1/20 0.50
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KCNH2 Q12809 1/20 0.47
FABP3 P05413 1/20 0.45
FABP4 P15090 1/20 0.45

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
SCHEMBL13951556 0.86 DHODH (0.65) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL2406388 0.84 DHODH (0.64) DHODH
SCHEMBL31500217 0.83 MEN1 (0.82) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL11486316 0.83 MEN1 (0.82) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL31500229 0.81 AKR1C3 (0.72) DHODHMEN1KMT2AAKR1C3AKR1C2
SCHEMBL2405029 0.81 DHODH (0.58) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL2405389 0.80 DHODH (0.66) DHODH
SCHEMBL15400944 0.79 DHODH (0.53) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL468572 0.79 DHODH (1.00) DHODHMEN1KMT2AUSP2PABPC1
SCHEMBL11604753 0.77 KDM4E (0.68) DHODHMEN1KMT2AAKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140005178-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2014-01-02 US disclosed
US-8536165-B2 Azabiphenylaminobenzoic acid derivatives as DHODH inhibitors ALMIRALL, S.A. (ES) 2013-09-17 US disclosed
US-8536165-B2 Azabiphenylaminobenzoic acid derivatives as DHODH inhibitors ALMIRALL, S.A. (ES) 2013-09-17 US disclosed
EP-2178840-B1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL SA (ES) 2011-12-14 EP disclosed
US-20110212945-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2011-09-01 US disclosed
US-20110212945-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2011-09-01 US disclosed
EP-2178840-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS Almirall, S.A. (ES) 2010-04-28 EP disclosed
EP-2100881-A1 Pyrimidyl- or pyridinylaminobenzoic acid derivatives Laboratorios Almirall, S.A. (ES) 2009-09-16 EP disclosed
EP-2100881-A1 Pyrimidyl- or pyridinylaminobenzoic acid derivatives Laboratorios Almirall, S.A. (ES) 2009-09-16 EP disclosed
WO-2009021696-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS ALMIRALL, S.A. (ES) 2009-02-19 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 (2 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 1/4885MEN1 4484/4885KMT2A 1734/4885
US-20110212945-A1 AZABIPHENYLAMINOBENZOIC ACID DERIVATIVES AS DHODH INHIBITORS DHODH, DPYD, DLD DHODH 1/4885MEN1 4484/4885KMT2A 1734/4885

“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.