SCHEMBL7181950

SCHEMBL7181950

CC(C)(C)OC(=O)N1CCN(CCc2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 3/20 0.45
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
ABCB1 P08183 1/20 0.41
EPHX2 P34913 2/20 0.41
ACHE P22303 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
TERT O14746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
POLB P06746 1/20 0.40
GPR119 Q8TDV5 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
SCHEMBL947677 0.85 KDM4E (0.49) GPR119
SCHEMBL14433203 0.80 GPR119 (0.46) GPR119
SCHEMBL4301302 0.80 TACR1 (0.42) CKS1BSKP1SKP2GPR119
SCHEMBL7719017 0.78 USP30 (0.51) GPR119
SCHEMBL7719020 0.78 USP30 (0.51) GPR119
SCHEMBL3954399 0.78 THRB (0.58) ACKR3CHRM2CHRM4CHRM1CHRM3
SCHEMBL1448716 0.76 TACR1 (0.41) CKS1BSKP1SKP2
SCHEMBL1448717 0.76 LMNA (0.41)
SCHEMBL3712707 0.76 MEN1 (0.59) ACKR3CHRM2CHRM4CHRM1CHRM3
SCHEMBL6617534 0.76 MAPK1 (0.40) CHRM2CHRM4CHRM1CHRM3CKS1B

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
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed