SCHEMBL9012389

SCHEMBL9012389

C=CCC(C)OC(=O)C(C)CC=C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL23200430 0.80 TSHR (0.40) TSHRTDP1MEN1KMT2A
SCHEMBL9246267 0.80 TSHR (0.35) TSHRTDP1
SCHEMBL766965 0.80 TSHR (0.35) TSHRTDP1
SCHEMBL15732726 0.80 TSHR (0.34) TSHRTDP1
SCHEMBL19559253 0.79
SCHEMBL4188929 0.78
SCHEMBL12890924 0.78
SCHEMBL12890928 0.78
SCHEMBL16774771 0.78
SCHEMBL9541746 0.78

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-5525506-A Process for production of avermectins and cultures therefor PFIZER INC. (US) 1996-06-11 US disclosed
US-5238848-A Cultures for production of avermectins PFIZER INC (US) 1993-08-24 US disclosed
US-5077278-A Parasiticides PFIZER INC. (US) 1991-12-31 US disclosed