SCHEMBL6047722

SCHEMBL6047722

[CH2]C(C)(O)CCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.46
GGPS1 O95749 7/20 0.46
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
SMPD1 P17405 1/20 0.42
CES2 O00748 1/20 0.40

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
SCHEMBL29189123 1.00 FDPS (0.46) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL11432930 1.00 FDPS (0.46) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL28036795 1.00 FDPS (0.46) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL9650717 0.97
SCHEMBL11442316 0.89
SCHEMBL7129095 0.81 FDPS (0.48) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL2707317 0.81 FDPS (0.48) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL1685841 0.81 FDPS (0.48) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL4633334 0.81 FDPS (0.48) FDPSGGPS1TSHRTHRBSMPD1
SCHEMBL28746873 0.81 FDPS (0.48) FDPSGGPS1TSHRTHRBSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074387-B2 DTPA monoamides, pharmaceutical agents containing these compounds, their use and process for their production SCHERING AG (DE) 2006-07-11 US claimed
US-4188403-A Cyclopentan-1-amines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-02-12 US disclosed
US-3932487-A HYPOTENSIVE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-13 US disclosed