SCHEMBL24124368

SCHEMBL24124368

CCCC[C@@H](COC)NC(C)=O

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 10/20 0.71
PLA2G2A P14555 5/20 0.57
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ACACB O00763 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
PLA2G1B P04054 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
SCHEMBL12820064 0.89 PLA2G2C (0.56) PLA2G2CPLA2G2AACACBTAS1R3TAS1R1
SCHEMBL6547737 0.84 PLA2G2C (0.62) PLA2G2CPLA2G2ACA1CA2
SCHEMBL22083015 0.82 PLA2G2C (0.46) PLA2G2CPLA2G2ACA1CA2ACACB
SCHEMBL11506429 0.80 PLA2G2C (0.59) PLA2G2CPLA2G2ACA1CA2TAS1R3
SCHEMBL17506705 0.80 TAS1R3 (0.47) PLA2G2CPLA2G2ACA1CA2ACACB
SCHEMBL13715798 0.80 PLA2G2C (0.59) PLA2G2CPLA2G2ACA1CA2
SCHEMBL13888611 0.80 TAS1R3 (0.47) PLA2G2CPLA2G2ACA1CA2ACACB
SCHEMBL20925463 0.79 PLA2G2C (0.62) PLA2G2CPLA2G2ACA1CA2TAS1R3
SCHEMBL13587912 0.79 PLA2G2C (0.57) PLA2G2CPLA2G2ACA1CA2
SCHEMBL2666554 0.79 PLA2G2C (0.67) PLA2G2CPLA2G2ACA2

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
WO-2021257568-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF ALNYLAM PHARMACEUTICALS, INC. (US) 2021-12-23 WO disclosed