SCHEMBL9851940

SCHEMBL9851940

CCCCC(CO)C(CO)CCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
LMNA P02545 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DNM1 Q05193 2/20 0.36
FDPS P14324 1/20 0.36
CYP2D6 P10635 2/20 0.35
SPHK1 Q9NYA1 1/20 0.35
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL28367852 0.93 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL9311012 0.93 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL6463333 0.92 ALDH1A1 (0.55) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL27686213 0.90 LMNA (0.56) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL9008313 0.90 LMNA (0.56) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL28486523 0.90 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL21694617 0.89 ALDH1A1 (0.52) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL4576295 0.89 ALDH1A1 (0.47) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL14416556 0.88 LMNA (0.54) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10
SCHEMBL1614709 0.86 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0459592-A2 Modified epoxy resin composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-12-04 EP disclosed
EP-0281213-A2 Process for the preparation of a modified epoxy resin SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-09-07 EP disclosed