SCHEMBL1491997

SCHEMBL1491997

O=C1CCCCC(C2CCC(=O)O2)O1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.44
CA9 Q16790 2/20 0.44
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
TSHR P16473 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 2/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL4353566 0.95 CA1 (0.42) CA1CA9CA2CA4TSHR
SCHEMBL2127362 0.95 CA1 (0.42) CA1CA9CA2CA4TSHR
SCHEMBL5880374 0.93 CA1 (0.46) CA1CA9TSHRLMNACYP1A2
SCHEMBL7808875 0.93 CA1 (0.41) CA1CA9CA2CA4TSHR
SCHEMBL7643331 0.87 CA1 (0.55) CA1CA9TSHRLMNACYP1A2
SCHEMBL6854823 0.87 CA1 (0.55) CA1CA9TSHRLMNACYP1A2
SCHEMBL9973225 0.87 CA1 (0.55) CA1CA9TSHRLMNACYP1A2
SCHEMBL16120995 0.87 CA1 (0.55) CA1CA9TSHRLMNACYP1A2
SCHEMBL6857004 0.87 CA1 (0.55) CA1CA9TSHRLMNACYP1A2
SCHEMBL3389129 0.86 CA1 (0.37) CA1CA9CA2CA4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2014695-B1 Aliphatic polyester polymer compositions and preparation method thereof IND TECH RES INST (TW) 2011-05-04 EP disclosed
US-7902303-B2 Aliphatic polyester polymer compositions and preparation method thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2011-03-08 US disclosed
EP-2014695-A1 Aliphatic polyester polymer compositions and preparation method thereof Industrial Technology Research Institut (TW) 2009-01-14 EP disclosed
US-20080194772-A1 Method For Producing an Aqueous Polymer Dispersion BASF AKTIENGESELLSCHAFT (DE) 2008-08-14 US disclosed
US-20070155943-A1 Aliphatic polyester polymer compositions and preparation method thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2007-07-05 US disclosed