SCHEMBL8570869

SCHEMBL8570869

CCCC(C)(C(=O)O)C(C)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 4/20 0.32
TP53 P04637 1/20 0.32
KDM4C Q9H3R0 1/20 0.31
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31
ADRA1A P35348 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 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
SCHEMBL8574669 0.87 ACACB (0.41) ACACBACACACA2MAPK1GPR84
SCHEMBL11416843 0.84 ACACB (0.36) ACACBACACAALDH1A1LMNAHSD17B10
SCHEMBL1028185 0.84 TSHR (0.33) ACACBACACAALDH1A1LMNAHSD17B10
SCHEMBL28594627 0.82 ACACB (0.35) ACACBACACAALDH1A1TSHRTP53
SCHEMBL8567184 0.81 TSHR (0.35) ACACBACACAALDH1A1TSHRTP53
SCHEMBL599201 0.81 TSHR (0.35) ACACBACACAALDH1A1TSHRTP53
SCHEMBL7645814 0.80 TSHR (0.42) ACACBACACAALDH1A1LMNAHSD17B10
SCHEMBL15563581 0.80 LMNA (0.35) ACACBACACAALDH1A1LMNAHSD17B10
SCHEMBL12113778 0.80 CA2 (0.34) ACACBACACAALDH1A1LMNAHSD17B10
Ammonia Solution, Strong SCHEMBL27515446 0.79 TSHR (0.33) ACACBACACAALDH1A1TSHRTP53

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-5830936-A THERMAL STABILIZERS FOR POLYOLEFINS AND ENGINEERING PLASTICS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-11-03 US disclosed