SCHEMBL5354570

SCHEMBL5354570

CC(C)(C)OC(=O)NCCc1cccc(Oc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 4/20 0.57
IDO1 P14902 1/20 0.50
GLI1 P08151 1/20 0.50
GLI2 P10070 1/20 0.50
AKR1C3 P42330 1/20 0.49
PLAAT3 P53816 2/20 0.49
PLAAT5 Q96KN8 2/20 0.49
PLAAT2 Q9NWW9 2/20 0.49
PLAAT4 Q9UL19 2/20 0.49
NQO2 P16083 1/20 0.48
LTA4H P09960 1/20 0.48
PLA2G2A P14555 1/20 0.48
NAMPT P43490 1/20 0.47

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
SCHEMBL21090366 0.91 FDFT1 (0.47) FDFT1IDO1GLI1GLI2NQO2
SCHEMBL6203942 0.90 FDFT1 (0.47) FDFT1IDO1GLI1GLI2AKR1C3
SCHEMBL13886599 0.88 EPHX2 (0.59) IDO1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL67569 0.88 CYP2D6 (0.58) IDO1NQO2LTA4HPLA2G2A
SCHEMBL31506266 0.88 CYP2D6 (0.58) IDO1NQO2LTA4HPLA2G2A
SCHEMBL21090363 0.87 CYP4F2 (0.49) FDFT1AKR1C3NQO2
SCHEMBL6204579 0.87 MTNR1A (0.58)
SCHEMBL6202190 0.85 PLAAT3 (0.48) FDFT1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL6204512 0.85 FDFT1 (0.43) FDFT1IDO1PLAAT3PLAAT5PLAAT2
SCHEMBL572740 0.85 IDO1 (0.60) IDO1NAMPT

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
US-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 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-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 FDFT1 2366/4885IDO1 86/4885GLI1 247/4885

“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.