SCHEMBL30985187

SCHEMBL30985187

O=C1CC2(CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.62
MAPT P10636 4/20 0.58
ALDH1A1 P00352 3/20 0.55
SIRT6 Q8N6T7 2/20 0.55
POLB P06746 1/20 0.55
ADRB1 P08588 1/20 0.55
LMNA P02545 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
GAA P10253 1/20 0.48
AKR1C3 P42330 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL13247587 0.81 SIRT6 (0.73) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL18283605 0.81 MAPT (0.58) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL21526328 0.81 SIRT6 (0.64) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL22466180 0.81 MAPT (0.57) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL25366550 0.80 SIRT6 (0.67) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL22471328 0.80 SIRT6 (0.67) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL10035909 0.80 SIRT6 (0.71) CRBNMAPTALDH1A1SIRT6POLB
SCHEMBL15271381 0.79 SIRT6 (0.81) MAPTALDH1A1SIRT6POLBADRB1
SCHEMBL6151230 0.79 SIRT6 (0.81) MAPTALDH1A1SIRT6POLBADRB1
SCHEMBL10036165 0.79 SIRT6 (0.65) CRBNMAPTALDH1A1SIRT6POLB

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 WO disclosed