SCHEMBL6437199

SCHEMBL6437199

CCCCCCCCC(CCCCCC)NC(=O)c1cc(C(=O)NC(CCCCCC)CCCCCCCC)cc(C(=O)NC(CCCCCC)CCCCCCCC)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 16/20 0.54
TAS1R1 Q7RTX1 16/20 0.54
MLYCD O95822 1/20 0.46
PLA2G2C Q5R387 1/20 0.45
PRSS1 P07477 2/20 0.45
CTSG P08311 2/20 0.45
CTRB1 P17538 2/20 0.45
CMA1 P23946 2/20 0.45

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
SCHEMBL13350409 0.85 TAS1R3 (0.66) TAS1R3TAS1R1
SCHEMBL165896 0.85 PRSS1 (0.61) TAS1R3TAS1R1MLYCDPRSS1CTSG
SCHEMBL24193420 0.85 TAS1R3 (0.58) TAS1R3TAS1R1MLYCDPRSS1CTSG
SCHEMBL30868632 0.82 TAS1R3 (0.77) TAS1R3TAS1R1MLYCDPRSS1CTSG
SCHEMBL22747924 0.81 PRSS1 (0.59) TAS1R3TAS1R1MLYCDPRSS1CTSG
SCHEMBL28010260 0.81 TAS1R3 (0.61) TAS1R3TAS1R1MLYCD
SCHEMBL31616421 0.80 TAS1R3 (0.52) TAS1R3TAS1R1
SCHEMBL31616454 0.80 TAS1R3 (0.52) TAS1R3TAS1R1
SCHEMBL23604966 0.79 MAPK1 (0.55) TAS1R3TAS1R1
SCHEMBL12781902 0.79 TAS1R3 (0.43) TAS1R3TAS1R1PLA2G2CPRSS1CTSG

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-20050077648-A1 Solution casting method and polymer film FUJIFILM CORPORATION (JP) 2005-04-14 US disclosed