SCHEMBL5607393

SCHEMBL5607393

Cc1ccc(Oc2ccc(-c3nn[nH]n3)cc2)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XDH P47989 5/20 0.51
ALDH1A1 P00352 2/20 0.50
MAP3K8 P41279 2/20 0.49
CCNC P24863 1/20 0.49
CDK8 P49336 1/20 0.49
TP53 P04637 1/20 0.49
CYP2C9 P11712 2/20 0.47
CYP19A1 P11511 1/20 0.47
CYP2C19 P33261 1/20 0.47
ADH5 P11766 1/20 0.46
GRM2 Q14416 2/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.44
MAP2K1 Q02750 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL5607371 0.79 KDM4E (0.52) XDHALDH1A1MAP3K8CYP2C9GAA
SCHEMBL5607415 0.76 AR (0.40) XDHCYP2C9GAAKMT2A
SCHEMBL16309243 0.76 AR (0.54) ALDH1A1KMT2A
SCHEMBL2667739 0.74 ADH5 (0.75) XDHALDH1A1TP53CYP2C9CYP19A1
SCHEMBL5606572 0.74 AR (0.40) XDHTP53KMT2A
SCHEMBL762116 0.73 ADH5 (0.79) XDHALDH1A1TP53CYP2C9CYP19A1
SCHEMBL5607695 0.72 KDM4E (0.65) XDHALDH1A1CYP2C9CYP2C19GAA
SCHEMBL12386586 0.70 AR (0.49) ALDH1A1CYP2C9CYP2C19KMT2AL3MBTL1
SCHEMBL5607469 0.70 TEAD4 (0.57) ALDH1A1
SCHEMBL5606163 0.70 SMN1; SMN2 (0.57) ALDH1A1TP53GAAKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838300-A2 2-(2 OR 4-SUBSTITUTED ARYLOXY)-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS Emergent Product Development Gaithersburg Inc. (US) 2007-10-03 EP claimed
US-20060211697-A1 2-(2 Or 4-substituted aryloxy)-phenol derivatives as antibacterial agents EMERGENT PRODUCT DEVELOPMENT GAITHERSBURG, INC. 2006-09-21 US claimed
WO-2006071471-A2 2-(2 OR 4-SUBSTITUTED ARYLOXY)-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT PRODUCT DEVELOPMENT GAITHERSBURG INC. (US) 2006-07-06 WO claimed
EP-1838300-A2 2-(2 OR 4-SUBSTITUTED ARYLOXY)-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS Emergent Product Development Gaithersburg Inc. (US) 2007-10-03 EP disclosed
US-20060211697-A1 2-(2 Or 4-substituted aryloxy)-phenol derivatives as antibacterial agents EMERGENT PRODUCT DEVELOPMENT GAITHERSBURG, INC. 2006-09-21 US disclosed
WO-2006071471-A2 2-(2 OR 4-SUBSTITUTED ARYLOXY)-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT PRODUCT DEVELOPMENT GAITHERSBURG INC. (US) 2006-07-06 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-20060211697-A1 2-(2 Or 4-substituted aryloxy)-phenol derivatives as antibacterial agents TYR, NFE2L2, CYP1A1 XDH 236/4885ALDH1A1 1406/4885MAP3K8 1376/4885

“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.