SCHEMBL10649840

SCHEMBL10649840

CC(C)(OC(=O)CCCCC(=O)OC(C)(C)C1CCCCC1)C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.45
EPHX2 P34913 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.35
SSTR4 P31391 1/20 0.35
KMT2A Q03164 2/20 0.33
EPHX1 P07099 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
LMNA P02545 2/20 0.33

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
SCHEMBL10649845 0.93 NAAA (0.41) NAAAEPHX2EPHX1LMNA
SCHEMBL28216713 0.93 NAAA (0.55) NAAAEPHX2KMT2AMEN1LMNA
SCHEMBL28189672 0.92 NAAA (0.58) NAAAEPHX2MAPTLMNA
SCHEMBL27496795 0.91 NAAA (0.42) NAAAEPHX2SMN1; SMN2SSTR4KMT2A
SCHEMBL12811983 0.89 NAAA (0.36) NAAAEPHX2SMN1; SMN2SSTR4KMT2A
SCHEMBL2382714 0.87 NAAA (0.40) NAAAEPHX2SSTR4KMT2AEPHX1
SCHEMBL13527826 0.86 HDAC4 (0.33) NAAAEPHX2SMN1; SMN2SSTR4KMT2A
SCHEMBL118416 0.83 SSTR4 (0.36) NAAAEPHX2SMN1; SMN2SSTR4EPHX1
SCHEMBL14549273 0.83 SSTR4 (0.36) NAAAEPHX2SMN1; SMN2SSTR4KMT2A
SCHEMBL26353243 0.83 SSTR4 (0.36) NAAAEPHX2SMN1; SMN2SSTR4EPHX1

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
US-4772329-A UNSATURATED PREPOLYMER BAYER AKTIENGESELLSCHAFT (DE) 1988-09-20 US disclosed
US-4764548-A Tile adhesive based on water-dilutable, cellulose-containing pastes WOLFF WALSRODE AKTIENGESELLSCHAFT (DE) 1988-08-16 US disclosed