SCHEMBL31737070

SCHEMBL31737070

Cn1c(=O)n(C)c2cc(CNc3ccccc3N)ccc21

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.53
▸ THRB P10828 2/20 0.50
▸ TP53 P04637 11/20 0.49
▸ MAPT P10636 10/20 0.49
▸ GAA P10253 8/20 0.47
▸ SMN1; SMN2 Q16637 8/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.43
▸ HDAC1 Q13547 1/20 0.42

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
SCHEMBL31737135 0.80 KDM4E (0.53) POLBTHRBTP53MAPTGAA
SCHEMBL31737098 0.80 MAPT (0.55) POLBTHRBTP53MAPTGAA
SCHEMBL31737545 0.78 POLB (0.48) POLBTHRBTP53MAPTGAA
SCHEMBL30832795 0.76 TRIM24 (0.51) TP53MAPTGAASMN1; SMN2ALDH1A1
SCHEMBL20772684 0.76 TRIM24 (0.51) TP53MAPTGAASMN1; SMN2ALDH1A1
SCHEMBL7164883 0.74 BACE1 (0.56) POLBTHRBMAPTGAAALDH1A1
SCHEMBL10208756 0.73 POLB (0.60) POLBTHRBTP53GAASMN1; SMN2
SCHEMBL7169755 0.72 BACE1 (0.51) MAPTGAAALDH1A1HDAC1
SCHEMBL32685198 0.71 POLB (0.55) POLBTHRBTP53MAPTGAA
SCHEMBL13156353 0.71 POLB (0.53) POLBTHRBTP53SMN1; SMN2ALDH1A1

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
WO-2025245367-A1 INHIBITING CATECHOL-O-METHYLTRANSFERASE (COMT) PSY THERAPEUTICS, INC. (US) 2025-11-27 — — WO disclosed
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