SCHEMBL4021989

SCHEMBL4021989

CC(=O)N(c1cnoc1C)C(C)C1CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.36
LMNA P02545 1/20 0.36
ALOX5 P09917 1/20 0.33
CHRNA4 P43681 1/20 0.31
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30

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
SCHEMBL6594480 0.82 ALDH1A1 (0.34) LMNA
SCHEMBL1448022 0.75 LMNA (0.37) LMNACHRNA4TAS1R3TAS1R1TAS1R2
SCHEMBL4027824 0.73 LMNA (0.45) LMNACHRNA4S1PR1S1PR3TAS1R3
SCHEMBL4247716 0.71 LMNA (0.41) LMNACHRNA4S1PR1S1PR3TAS1R3
SCHEMBL1447382 0.71 LMNA (0.54) TRPM8LMNACHRNA4S1PR1S1PR3
SCHEMBL4251064 0.70 LMNA (0.52) TRPM8LMNAS1PR1S1PR3TAS1R3
SCHEMBL4027100 0.70 LMNA (0.37) LMNACHRNA4TAS1R3TAS1R1TAS1R2
SCHEMBL3557090 0.69 SMN1; SMN2 (0.37) LMNA
SCHEMBL4020643 0.67 LMNA (0.37) LMNA
SCHEMBL6593091 0.66 MLYCD (0.33) LMNA

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-1485375-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2009-06-17 EP disclosed