SCHEMBL22761256

SCHEMBL22761256

O=C(C[C@]1(O)C(=O)N(CCCc2c[nH]c3ccccc23)c2ccccc21)c1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CBX7 O95931 3/20 0.51
▸ CDYL Q9Y232 3/20 0.51
▸ CDY1; CDY1B Q9Y6F8 3/20 0.51
▸ CDYL2 Q8N8U2 2/20 0.51
▸ ALDH1A1 P00352 6/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ CDK4 P11802 1/20 0.47
▸ CCND1 P24385 1/20 0.47
▸ MAPT P10636 4/20 0.45
▸ TP53 P04637 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ LMNA P02545 1/20 0.44

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
SCHEMBL23615754 1.00 CBX7 (0.51) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615650 0.95 ALDH1A1 (0.50) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615705 0.95 ALDH1A1 (0.50) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615701 0.92 TP53 (0.51) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL22761102 0.92 TP53 (0.51) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL22761263 0.91 TP53 (0.52) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL22761015 0.90 ALDH1A1 (0.53) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615668 0.90 ALDH1A1 (0.53) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615745 0.90 CBX7 (0.54) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1
SCHEMBL23615673 0.90 CBX7 (0.51) CBX7CDYLCDY1; CDY1BCDYL2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11247982-B2 NMDA receptor modulators, compositions comprising same and use of these compounds in the treatment of diseases involving the central nervous system ADPUERIVITAM (FR) 2022-02-15 — — US disclosed
EP-3634957-B1 NMDA RECEPTOR MODULATORS, COMPOSITIONS COMPRISING SAME AND USE OF THESE COMPOUNDS IN THE TREATMENT OF DISEASES INVOLVING THE CENTRAL NERVOUS SYSTEM ADPUERIVITAM (FR) 2021-07-07 — — EP disclosed
US-20200385363-A1 NMDA Receptor Modulators, Compositions Comprising Same And Use of These Compounds in the Treatment of Diseases Involving the Central Nervous System ADPUERIVITAM (FR) 2020-12-10 — — 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-11247982-B2 NMDA receptor modulators, compositions comprising same and use of these compounds in the treatment of diseases involving the central nervous system GRIN3A, GRIN1, GRIN2A CBX7 4474/4885CDYL 3286/4885CDY1; CDY1B 4092/4885
US-20200385363-A1 NMDA Receptor Modulators, Compositions Comprising Same And Use of These Compounds in the Treatment of Diseases Involving the Central Nervous System GRIN1, GRIN2A, GRIN3A CBX7 4137/4885CDYL 3330/4885CDY1; CDY1B 3442/4885

“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.

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