SCHEMBL2867606

SCHEMBL2867606

OCCCC(O)CCC(O)CCO

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.53
PTPN1 P18031 1/20 0.39
DPP4 P27487 1/20 0.35
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 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
SCHEMBL11314339 1.00 THRB (0.53) THRBPTPN1DPP4ACACBACACA
SCHEMBL35907 0.97
SCHEMBL15172005 0.97
SCHEMBL3844086 0.94 THRB (0.42) THRBPTPN1DPP4ACACBACACA
SCHEMBL26110715 0.94 THRB (0.42) THRBPTPN1DPP4ACACBACACA
SCHEMBL21566550 0.91 THRB (0.50) THRBPTPN1ACACBACACA
SCHEMBL758285 0.90 THRB (0.44) THRBPTPN1ACACBACACAALDH1A1
SCHEMBL14331574 0.88 THRB (0.48) THRBPTPN1ACACBACACAALDH1A1
SCHEMBL9420468 0.88 THRB (0.53) THRBPTPN1ACACBACACA
SCHEMBL4202345 0.87 THRB (0.67) THRBDPP4ALDH1A1LMNA

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
EP-1800740-B1 Method for manufacturing water-absorbing resin NIPPON CATALYTIC CHEM IND (JP) 2021-12-08 EP disclosed
US-7851550-B2 Method for surface crosslinking water-absorbing resin and method for manufacturing water-absorbing resin NIPPON SHOKUBAI CO., LTD. (JP) 2010-12-14 US disclosed
US-20070149760-A1 Method for surface crosslinking water-absorbing resin and method for manufacturing water-absorbing resin NIPPON SHOKUBAI CO., LTD. (JP) 2007-06-28 US disclosed