SCHEMBL29707355

SCHEMBL29707355

CC(C)(C)OC(=O)N1CCN(c2ccc(C=O)cc2-c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.50
SKP1 P63208 2/20 0.50
SKP2 Q13309 2/20 0.50
BACE1 P56817 6/20 0.48
KIT P10721 1/20 0.48
SMARCA2 P51531 1/20 0.47
SMARCA4 P51532 1/20 0.47
PBRM1 Q86U86 1/20 0.47
GPR119 Q8TDV5 1/20 0.46
PDK2 Q15119 1/20 0.44
PIK3CA P42336 1/20 0.44
GBA1 P04062 1/20 0.44
ABCB1 P08183 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
ALK Q9UM73 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
NAMPT P43490 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
SCHEMBL6266142 0.86 SMARCA2 (0.49) CKS1BSKP1SKP2BACE1KIT
SCHEMBL19212321 0.84 ALDH1A3 (0.46) ALDH1A1MAPT
SCHEMBL25402115 0.84 SMARCA2 (0.54) CKS1BSKP1SKP2BACE1KIT
SCHEMBL31121084 0.84 SMARCA2 (0.54) CKS1BSKP1SKP2BACE1KIT
SCHEMBL20818663 0.83 CKS1B (0.58) CKS1BSKP1SKP2BACE1KIT
SCHEMBL4941483 0.82 ALDH1A3 (0.57) BACE1SMARCA2SMARCA4PBRM1GPR119
SCHEMBL17756944 0.82 LMNA (0.47) CKS1BSKP1SKP2BACE1SMARCA2
SCHEMBL29707378 0.82 LMNA (0.47) CKS1BSKP1SKP2BACE1SMARCA2
SCHEMBL12595780 0.82 ALDH1A1 (0.59) SMARCA2SMARCA4PBRM1GPR119ABCB1
SCHEMBL28931821 0.82 NR1H2 (0.47) BACE1

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-3414252-B1 THIENOPYRIDINE CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO HEALTH INC (US) 2022-07-06 EP disclosed