SCHEMBL6639795

SCHEMBL6639795

CC(C)(C)OC(=O)N1CCN(C2=CC[CH]C=C2)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.42
USP2 O75604 1/20 0.42
GPR119 Q8TDV5 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
NAMPT P43490 1/20 0.40
MAP4K4 O95819 1/20 0.40
CYP2C19 P33261 1/20 0.39
SMARCA2 P51531 1/20 0.39
SMARCA4 P51532 1/20 0.39
PBRM1 Q86U86 1/20 0.39
POLB P06746 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
SCHEMBL2476143 0.80 ALDH1A1 (0.38) ALDH1A1LMNAMAPTSMN1; SMN2NAMPT
SCHEMBL693163 0.76 MAPT (0.50) ALDH1A1MAPTGPR119KMT2ANAMPT
SCHEMBL2483206 0.75 USP2 (0.39) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL31349154 0.75 ALDH1A1 (0.43) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL18294 0.73 USP2 (0.69) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL698803 0.73 USP2 (0.69) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL5573222 0.72 MAPT (0.76) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL2479566 0.72 SMO (0.37) MAPTSMN1; SMN2MEN1KMT2ACYP2C19
SCHEMBL26353773 0.72 LMNA (0.41) ALDH1A1LMNAMAPTSMN1; SMN2USP2
SCHEMBL5683429 0.71 MAPT (0.57) ALDH1A1LMNAMAPTSMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP claimed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO claimed
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP disclosed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO disclosed