SCHEMBL11323974

SCHEMBL11323974

COC(CC(C)O)C(C)=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 2/20 0.31

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
SCHEMBL1781745 0.83 LAP3 (0.36) KISS1R
SCHEMBL14560234 0.83 LAP3 (0.36) KISS1R
SCHEMBL2849500 0.81 TP53 (0.39)
SCHEMBL1784715 0.79
SCHEMBL1782678 0.77 KISS1R (0.32) KISS1R
SCHEMBL1782972 0.77 MAPT (0.30)
SCHEMBL28213348 0.76 MAPT (0.31)
SCHEMBL1782971 0.76
SCHEMBL11313585 0.76 TSHR (0.45)
SCHEMBL1783996 0.74 TSHR (0.38)

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-4252530-A USING A BASE AS DISCHARGE AGENT IN A DISCHARGE RESIST PASTE AND HEATING CASSELLA AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed