SCHEMBL9336573

SCHEMBL9336573

CCCCCCCCCCCCCCCCCCOC(COCCOCCOCCOCCO)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
THRB P10828 1/20 0.59
HTT P42858 1/20 0.59
KMT2A Q03164 1/20 0.59
MAPT P10636 1/20 0.59
LPAR1 Q92633 4/20 0.51
LPAR3 Q9UBY5 4/20 0.51
TLR2 O60603 9/20 0.48
LPAR2 Q9HBW0 1/20 0.48
TSHR P16473 1/20 0.46
USP2 O75604 1/20 0.45
PLA2G2C Q5R387 1/20 0.44

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
SCHEMBL30826314 0.91 LPAR1 (0.59) HTTLPAR1LPAR3TLR2LPAR2
SCHEMBL6914851 0.88 LPAR1 (0.47) LPAR1LPAR3TLR2LPAR2TSHR
SCHEMBL3243893 0.87 MEN1 (0.42) MEN1THRBHTTKMT2AMAPT
SCHEMBL11313784 0.85 MAPT (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL6247348 0.84 HTT (0.64) MEN1THRBHTTKMT2AMAPT
SCHEMBL8090207 0.84 LPAR1 (0.50) MEN1KMT2AMAPTLPAR1LPAR3
SCHEMBL10558616 0.83 HTT (0.69) MEN1THRBHTTKMT2AMAPT
SCHEMBL30381832 0.82 LPAR1 (0.47) LPAR1LPAR3TLR2LPAR2PLA2G2C
SCHEMBL30965420 0.81 HTT (0.67) MEN1THRBHTTKMT2AMAPT
SCHEMBL8505229 0.81 HTT (0.67) MEN1THRBHTTKMT2AMAPT

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-5300149-A Fluid flow mixtures consists of reduced water is hardened to form weatherproofing structures; workability, strength, freeze resistance THE LUBRIZOL CORPORATION (US) 1994-04-05 US disclosed
EP-0561627-A1 Cementitious compositions The Lubrizol Corporation (US) 1993-09-22 EP disclosed