SCHEMBL17512944

SCHEMBL17512944

CCC(CC)(CC)C(=O)OOOC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 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
SCHEMBL9045321 0.86 TSHR (0.36) CYP4F2CYP4A11TSHRALDH1A1HSD17B10
SCHEMBL29291915 0.85 CYP4F2 (0.38) CYP4F2CYP4A11
SCHEMBL6690279 0.85 CYP4F2 (0.41) CYP4F2CYP4A11
SCHEMBL11299311 0.79
SCHEMBL8844364 0.78 ELANE (0.31) TSHRALDH1A1TDP1
SCHEMBL94701 0.77 TSHR (0.35) TSHRALDH1A1HSD17B10TDP1
SCHEMBL8599248 0.76 DGAT1 (0.31)
SCHEMBL1763802 0.76 LMNA (0.32) HSD17B10
SCHEMBL11652800 0.74 FDPS (0.32)
Propane SCHEMBL2296352 0.73 TSHR (0.36) TSHRALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10459358-B2 Method for producing a toner ZEON CORPORATION (JP) 2019-10-29 US disclosed
US-20180307149-A1 METHOD FOR PRODUCING A TONER ZEON CORPORATION (JP) 2018-10-25 US disclosed
US-10012917-B2 Toner ZEON CORPORATION (JP) 2018-07-03 US disclosed
US-20170248856-A1 TONER ZEON CORPORATION (JP) 2017-08-31 US disclosed
US-20160054671-A1 TONER ZEON CORPORATION (JP) 2016-02-25 US disclosed