SCHEMBL8889987

SCHEMBL8889987

O=C1CC(C(=O)O)C(c2ccccc2)(c2ccccc2)O1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 1/20 0.42
HSD11B1 P28845 2/20 0.41
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HCAR3 P49019 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
MAOB P27338 1/20 0.35
CYP1A2 P05177 1/20 0.35
KCNN4 O15554 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
AKR1C1 Q04828 1/20 0.34

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
SCHEMBL27282666 0.87 SMN1; SMN2 (0.42) SMN1; SMN2TSHRLMNAHSD11B1KDM4E
SCHEMBL8889675 0.84 TSHR (0.43) SMN1; SMN2TSHRLMNAHSD11B1ALDH1A1
SCHEMBL31128665 0.84 HCAR3 (0.44) SMN1; SMN2TSHRHSD11B1KDM4EALDH1A1
SCHEMBL546932 0.68 LMNA (0.59) SMN1; SMN2TSHRLMNAALDH1A1CYP3A4
SCHEMBL9971714 0.68 DHODH (0.36) SMN1; SMN2TSHRLMNAHSD11B1ALDH1A1
SCHEMBL17192484 0.68 CFTR (0.42) SMN1; SMN2TSHRLMNAKDM4EALDH1A1
SCHEMBL11079999 0.67 MAOB (0.46) LMNAHSD11B1MAOBCYP2D6AKR1C1
SCHEMBL11077137 0.67 MAOB (0.46) LMNAHSD11B1MAOBCYP2D6AKR1C1
SCHEMBL10651717 0.67 MAOB (0.46) LMNAHSD11B1MAOBCYP2D6AKR1C1
SCHEMBL18815073 0.67 SIRT1 (0.39) SMN1; SMN2TSHRHSD11B1KDM4EALDH1A1

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
WO-2013008044-A1 SYNTHESIS OF (+) AND (-) 1 -(5,5-DIPHENYLTETRAHYDROFURAN-3- YL)-N,N-DIMETHYLMETHANAMINE, (+) AND (-) 1-(2,2-DIPHENYLTETRAHYDROFURAN-3-YL)-N,N- DIMETHYLMETHANAMINE AND (+) AND (-) 1-(2,2- DFFHENYLTETRAHYDROFURAN-3-YL)-N-METIHYLMETHANAMINE ANAVEX LIFE SCIENCES CORP. (GR) 2013-01-17 WO claimed
WO-1997030983-A1 TETRAHYDRO-N,N-DIMETHYL-2,2-DIPHENYL-3-FERANEMETHANAMINE, ITS ENANTIOMERS, AND THEIR PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALTS VAMVAKIDES ALEXANDRE (GR) 1997-08-28 WO claimed
US-12018005-B1 Blarcamesine co-crystals for the manufacture of pharmaceutical dosage form EGIS GYÓGYSZERGYÁR ZRT. (HU) 2024-06-25 US disclosed
US-12018005-B1 Blarcamesine co-crystals for the manufacture of pharmaceutical dosage form EGIS GYÓGYSZERGYÁR ZRT. (HU) 2024-06-25 US disclosed
WO-2013008044-A1 SYNTHESIS OF (+) AND (-) 1 -(5,5-DIPHENYLTETRAHYDROFURAN-3- YL)-N,N-DIMETHYLMETHANAMINE, (+) AND (-) 1-(2,2-DIPHENYLTETRAHYDROFURAN-3-YL)-N,N- DIMETHYLMETHANAMINE AND (+) AND (-) 1-(2,2- DFFHENYLTETRAHYDROFURAN-3-YL)-N-METIHYLMETHANAMINE ANAVEX LIFE SCIENCES CORP. (GR) 2013-01-17 WO disclosed
WO-2013008044-A1 SYNTHESIS OF (+) AND (-) 1 -(5,5-DIPHENYLTETRAHYDROFURAN-3- YL)-N,N-DIMETHYLMETHANAMINE, (+) AND (-) 1-(2,2-DIPHENYLTETRAHYDROFURAN-3-YL)-N,N- DIMETHYLMETHANAMINE AND (+) AND (-) 1-(2,2- DFFHENYLTETRAHYDROFURAN-3-YL)-N-METIHYLMETHANAMINE ANAVEX LIFE SCIENCES CORP. (GR) 2013-01-17 WO disclosed
WO-1997030983-A1 TETRAHYDRO-N,N-DIMETHYL-2,2-DIPHENYL-3-FERANEMETHANAMINE, ITS ENANTIOMERS, AND THEIR PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALTS VAMVAKIDES ALEXANDRE (GR) 1997-08-28 WO disclosed
WO-1997030983-A1 TETRAHYDRO-N,N-DIMETHYL-2,2-DIPHENYL-3-FERANEMETHANAMINE, ITS ENANTIOMERS, AND THEIR PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALTS VAMVAKIDES ALEXANDRE (GR) 1997-08-28 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-12018005-B1 Blarcamesine co-crystals for the manufacture of pharmaceutical dosage form PSEN2, PSEN1, APP SMN1; SMN2 101/4885TSHR 4559/4885LMNA 3366/4885

“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.