SCHEMBL29707409

SCHEMBL29707409

CC(C)(C)OC(=O)N1CCN(c2ccc(CC#N)c(F)c2F)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.47
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
SMARCA2 P51531 1/20 0.41
SMARCA4 P51532 1/20 0.41
PBRM1 Q86U86 1/20 0.41
PDK2 Q15119 1/20 0.41
EGLN2 Q96KS0 1/20 0.41
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
MEN1 O00255 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
CXCR2 P25025 1/20 0.39

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
SCHEMBL19212226 1.00 GPR119 (0.47) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL19212212 0.83 KMT2A (0.37) ALDH1A1LMNAMAPTMEN1CYP2C19
SCHEMBL22957295 0.82 GPR119 (0.46) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL3922803 0.82 GPR119 (0.48) GPR119ALDH1A1LMNAMAPTEGLN2
SCHEMBL28931834 0.82 NR1H2 (0.41) GPR119
SCHEMBL25403559 0.81 SMARCA2 (0.47) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL8436491 0.81 GPR119 (0.49) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL22957297 0.80 GPR119 (0.44) GPR119ALDH1A1LMNAMAPTSMARCA2
SCHEMBL29707320 0.78 MAPT (0.50) GPR119ALDH1A1LMNAMAPTPDK2
SCHEMBL8415583 0.78 GPR119 (0.49) GPR119ALDH1A1LMNAMAPTSMARCA2

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