SCHEMBL5774922

SCHEMBL5774922

CCOC(=O)c1c(NC(=O)c2ccc(Cl)cc2)c2ccc(-c3ccc(S(C)(=O)=O)cc3)cc2n1Cc1cccc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.43
ADORA3 P0DMS8 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
TP53 P04637 2/20 0.42
PTGS2 P35354 3/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
ABCB1 P08183 1/20 0.40
CYP19A1 P11511 1/20 0.39
CYP1A2 P05177 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 2/20 0.38
PTGES O14684 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
S1PR3 Q99500 1/20 0.38

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
SCHEMBL5738359 0.90 ADORA3 (0.46) MAPK8ADORA3ADORA2AADORA2BADORA1
SCHEMBL5749266 0.90 TP53 (0.45) MAPK8TP53ABCB1CYP19A1CYP1A2
SCHEMBL5738325 0.90 TP53 (0.46) MAPK8TP53ABCB1CYP19A1CYP1A2
SCHEMBL6089812 0.84 TP53 (0.46) TP53PTGS2CYP19A1MAPTKMT2A
SCHEMBL6092460 0.82 RXFP1 (0.44) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL5749488 0.81 PTGER4 (0.46) MAPK8ABCB1MAPTPTGESKMT2A
SCHEMBL6090346 0.80 MAPT (0.42) TP53MAPTS1PR3
SCHEMBL6092716 0.79 TP53 (0.42) MAPK8TP53MAPTPTGESKMT2A
SCHEMBL6093040 0.79 SERPINE1 (0.45) ABCB1RAB9APTGESSMN1; SMN2
SCHEMBL5748986 0.79 PTGER4 (0.42) ABCB1MAPTPTGESKMT2ASMN1; SMN2

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-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 US disclosed
EP-1646624-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2006-04-19 EP disclosed
WO-2005005415-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-01-20 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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 MAPK8 3463/4885ADORA3 594/4885ADORA2A 428/4885

“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.