SCHEMBL8950634

SCHEMBL8950634

COCC(C)(C)CCCO

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
FFAR1 O14842 1/20 0.30
CPT2 P23786 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
SCHEMBL17859042 0.84
SCHEMBL12094481 0.78 ACACB (0.34)
SCHEMBL13864353 0.77 SPHK2 (0.32) LMNATSHR
SCHEMBL16095997 0.77 ARG1 (0.32) ALDH1A1
SCHEMBL10258989 0.76 FFAR1 (0.31) TDP1FFAR1CPT2
SCHEMBL6448246 0.75 SMN1; SMN2 (0.42) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL12092743 0.75 SPHK2 (0.34) TSHR
SCHEMBL14304232 0.75 SMN1; SMN2 (0.33) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL3369720 0.75
SCHEMBL12094520 0.75 ACACB (0.40)

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-5502073-A INSECTICIDES OR ANTHELMINTICS THE WELLCOME FOUNDATION (GB) 1996-03-26 US disclosed
EP-0294229-B1 NOVEL HETEROCYCLIC PESTICIDAL COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-12-02 EP disclosed
EP-0294229-A2 Novel heterocyclic pesticidal compounds THE WELLCOME FOUNDATION LIMITED (GB) 1988-12-07 EP disclosed