SCHEMBL11796169

SCHEMBL11796169

CCCC(O)C(CC)(CC)CCCO

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL6910613 0.83 ALDH1A1 (0.35) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL11040133 0.82 TSHR (0.31) LMNATSHR
SCHEMBL27929543 0.82 ALDH1A1 (0.30) LMNAALDH1A1
SCHEMBL9778185 0.81 SMN1; SMN2 (0.33) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL8729348 0.78 SMN1; SMN2 (0.42) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL11042497 0.78 TSHR (0.31) LMNATSHR
SCHEMBL4995532 0.78 TSHR (0.35) LMNATSHR
SCHEMBL28477505 0.78 TSHR (0.35) LMNATSHR
SCHEMBL8897149 0.78 FDPS (0.31) LMNA
SCHEMBL18938915 0.77 LMNA (0.31) LMNATSHR

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-3956465-A EXTRACTION WITH ISOBUTANOL, GELATION INHIBITION AZOTE ET PRODUITS CHIMIQUES S.A. (FR) 1976-05-11 US disclosed