SCHEMBL6091145

SCHEMBL6091145

O=C(C=Cc1ccccc1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.53
GABRB1 P18505 1/20 0.53
GABRB2 P47870 1/20 0.53
GABBR1 Q9UBS5 1/20 0.53
LMNA P02545 5/20 0.48
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HDAC3 O15379 2/20 0.48
HDAC4 P56524 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
PLIN1 O60240 2/20 0.48
RECQL P46063 2/20 0.48
PLIN5 Q00G26 2/20 0.48
ABHD5 Q8WTS1 2/20 0.48
TNKS O95271 1/20 0.48
HCAR2 Q8TDS4 1/20 0.48

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
SCHEMBL12040547 1.00 GABBR2 (0.53) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL6090681 0.91 RARB (0.51) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL16053010 0.89 GABBR2 (0.50) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL16053009 0.89 GABBR2 (0.50) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL18317450 0.84 ALDH1A1 (0.45) LMNAALDH1A1MAPTSMN1; SMN2HDAC3
SCHEMBL8876584 0.84 HSD11B1 (0.51) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL18325433 0.84 ALDH1A1 (0.45) LMNAALDH1A1MAPTSMN1; SMN2HDAC3
SCHEMBL6090902 0.84 CYP1A2 (0.51) LMNAALDH1A1MAPTSMN1; SMN2HDAC3
SCHEMBL6092094 0.84 HSD11B1 (0.51) GABBR2GABRB1GABRB2GABBR1LMNA
SCHEMBL8068014 0.84 JUN (0.51) LMNAALDH1A1MAPTSMN1; SMN2TDP1

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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US claimed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 GABBR2 141/4885GABRB1 158/4885GABRB2 147/4885

“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.