SCHEMBL23615669

SCHEMBL23615669

O=C(CC1(O)C(=O)N(CCCc2c[nH]c3ccc(Cl)cc23)c2ccccc21)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 8/20 0.55
▸ MAPT P10636 5/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ LMNA P02545 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ ALDH1A1 P00352 9/20 0.50
▸ HPGD P15428 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ POLB P06746 2/20 0.48
▸ CBX7 O95931 1/20 0.48
▸ CDYL2 Q8N8U2 1/20 0.48
▸ CDYL Q9Y232 1/20 0.48
▸ CDY1; CDY1B Q9Y6F8 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45

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
SCHEMBL22761022 1.00 TP53 (0.55) TP53MAPTMEN1KMT2ALMNA
SCHEMBL23615674 0.97 TP53 (0.55) TP53MAPTMEN1KMT2ALMNA
SCHEMBL22761017 0.97 TP53 (0.55) TP53MAPTMEN1KMT2ALMNA
SCHEMBL22761016 0.95 TP53 (0.53) TP53MAPTMEN1KMT2ALMNA
SCHEMBL23615678 0.95 TP53 (0.53) TP53MAPTMEN1KMT2ALMNA
SCHEMBL22761325 0.95 TP53 (0.55) TP53MAPTMEN1KMT2ALMNA
SCHEMBL23615698 0.93 TP53 (0.52) TP53MAPTMEN1KMT2ALMNA
SCHEMBL22761094 0.93 TP53 (0.52) TP53MAPTMEN1KMT2ALMNA
SCHEMBL23615701 0.93 TP53 (0.51) TP53MAPTMEN1KMT2ALMNA
SCHEMBL22761102 0.93 TP53 (0.51) TP53MAPTMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
Send feedback