SCHEMBL3987464

SCHEMBL3987464

CC12CCCC1C2C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 7/20 0.54
CDC25A P30304 3/20 0.36
APLNR P35414 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
CYP1A2 P05177 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
FFAR3 O14843 1/20 0.32
CDC25B P30305 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
GFER P55789 1/20 0.32
SLC6A12 P48065 1/20 0.31
SLC6A11 P48066 1/20 0.31
AKR1B10 O60218 1/20 0.31

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
SCHEMBL3384132 0.94 UGT2B7 (0.53) UGT2B7CDC25AAPLNRMEN1KMT2A
SCHEMBL3984124 0.81 UGT2B7 (0.41) UGT2B7CDC25AGRIN1GRIN2BCDC25B
SCHEMBL30933029 0.78 UGT2B7 (0.39) UGT2B7CDC25AGRIN1GRIN2BCYP1A2
SCHEMBL3986262 0.75 UGT2B7 (0.40) UGT2B7MEN1KMT2AALDH1A1MAPT
SCHEMBL3984138 0.74 UGT2B7 (0.46) UGT2B7APLNRCYP1A2SLC1A2SLC1A1
SCHEMBL3984188 0.74 ALDH1A1 (0.43) UGT2B7MEN1KMT2AALDH1A1PSEN1
Isolongifolic Acid SCHEMBL29865033 0.71 UGT2B7 (1.00) UGT2B7
SCHEMBL3983378 0.70 UGT2B7 (0.34) UGT2B7CDC25AMEN1KMT2AALDH1A1
SCHEMBL29164241 0.70 UGT2B7 (0.46) UGT2B7APLNRCYP1A2SLC1A2SLC1A1
SCHEMBL3989824 0.69 UGT2B7 (0.36) UGT2B7CDC25AAPLNRGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562575-B1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY ABBOTT LAB (US) 2009-05-20 EP claimed
US-20040209859-A1 Fused cycloalkyl amides and acids and their therapeutic applications ABBOTT LABORATORIES 2004-10-21 US claimed
US-20040077617-A1 Fused cycloalkyl amides and acids and their therapeutic applications ABBOTT LABORATORIES 2004-04-22 US claimed
EP-1562575-B1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY ABBOTT LAB (US) 2009-05-20 EP disclosed
EP-1562575-A1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY Abbott Laboratories (US) 2005-08-17 EP disclosed
US-20040209859-A1 Fused cycloalkyl amides and acids and their therapeutic applications ABBOTT LABORATORIES 2004-10-21 US disclosed
WO-2004037241-A1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY ABBOTT LABORATORIES (US) 2004-05-06 WO disclosed
US-20040077617-A1 Fused cycloalkyl amides and acids and their therapeutic applications ABBOTT LABORATORIES 2004-04-22 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 (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-20040209859-A1 Fused cycloalkyl amides and acids and their therapeutic applications GRIN2A, GRIK1, GRIN2B UGT2B7 1481/4885CDC25A 2067/4885APLNR 947/4885
US-20040077617-A1 Fused cycloalkyl amides and acids and their therapeutic applications GRIN2A, GRIK1, GRIN2B UGT2B7 1481/4885CDC25A 2067/4885APLNR 947/4885

“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.