SCHEMBL4596733

SCHEMBL4596733

CC(C)C(=O)Oc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 1/20 0.46
ELANE P08246 2/20 0.46
HPGD P15428 1/20 0.45
CXCL8 P10145 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
FAAH O00519 3/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PARP10 Q53GL7 1/20 0.41

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
SCHEMBL1822201 0.87 ALDH1A1 (0.49) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL15547599 0.86 ALOX15 (0.55) ALDH1A1ELANEHPGDNPSR1ALOX15
SCHEMBL2014680 0.85 ALDH1A1 (0.51) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL8791825 0.85 ALDH1A1 (0.47) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL15670768 0.85 ALDH1A1 (0.51) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL15558143 0.84 SLC2A1 (0.48) ALDH1A1GAALMNAELANEHPGD
Bromide SCHEMBL16050020 0.84 ALOX15 (0.53) ALDH1A1GAAMAPTELANEHPGD
SCHEMBL10180088 0.82 ALDH1A1 (0.47) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL27685965 0.82 ALDH1A1 (0.46) ALDH1A1GAALMNASMN1; SMN2MAPT
SCHEMBL27988743 0.82 ALDH1A1 (0.46) ALDH1A1GAALMNASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786823-B1 ALKYLIDENE TETRAHYDRONAPHTHALENE DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AG (DE) 2008-01-16 EP disclosed
CN-101065386-A Alkylidene-tetrahydronaphthalene derivatives, process for their preparation and their use as anti-inflammatory agents SCHERING AG (DE) 2007-10-31 CN disclosed
EP-1786823-A1 ALKYLIDENE TETRAHYDRONAPHTHALENE DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS Bayer Schering Pharma Aktiengesellschaft (DE) 2007-05-23 EP disclosed
US-20060084652-A1 Alkylidene-tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents SCHERING AG (DE) 2006-04-20 US disclosed
WO-2006027236-A1 ALKYLIDENE TETRAHYDRONAPHTHALENE DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-03-16 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-20060084652-A1 Alkylidene-tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents PTGES, PTGS1, PTGES2 ALDH1A1 177/4885GAA 2648/4885LMNA 3160/4885

“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.