SCHEMBL6272800

SCHEMBL6272800

C=CCC=C(C)C(=O)OOCCCCC

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
PLA2G2C Q5R387 1/20 0.35
CES2 O00748 1/20 0.35
HPGD P15428 1/20 0.35
THRB P10828 3/20 0.33
THRA P10827 2/20 0.33
HCAR2 Q8TDS4 2/20 0.33
NAAA Q02083 1/20 0.33
FAAH O00519 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL325190 0.84 TSHR (0.54) TSHRHPGDHCAR2NAAAFAAH
SCHEMBL28202702 0.83 TSHR (0.41) TSHRCES2THRBTHRAHCAR2
SCHEMBL10761848 0.83 TSHR (0.57) TSHRCES2HPGDHCAR2NAAA
SCHEMBL9709320 0.83 TSHR (0.57) TSHRCES2HPGDHCAR2NAAA
SCHEMBL8971295 0.79 TSHR (0.50) TSHRHPGDHCAR2NAAACYP3A4
SCHEMBL17199696 0.78 ALDH1A1 (0.41) TSHRCES2HPGDTHRBTHRA
SCHEMBL8968101 0.76
SCHEMBL10764193 0.75 TSHR (0.38) TSHRHPGDTHRBHCAR2ALDH1A1
SCHEMBL28055228 0.74 TSHR (0.63) TSHRCES2HPGDTHRBHCAR2
SCHEMBL6274693 0.74 TSHR (0.42) TSHRPLA2G2CCES2HPGDHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390427-B1 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE CONSTR RES & TECH GMBH (DE) 2005-06-08 EP claimed
EP-1390427-A2 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE Construction Research & Technology GmbH (DE) 2004-02-25 EP claimed
US-20030119955-A1 Polymeric structural support membrane MBT HOLDING AG 2003-06-26 US claimed
US-20020151637-A1 Polymeric structural support membrane CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2002-10-17 US claimed
WO-2002070591-A2 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE MBT HOLDING AG (CH) 2002-09-12 WO claimed
EP-1390427-B1 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE CONSTR RES & TECH GMBH (DE) 2005-06-08 EP disclosed
EP-1390427-A2 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE Construction Research & Technology GmbH (DE) 2004-02-25 EP disclosed
US-20030119955-A1 Polymeric structural support membrane MBT HOLDING AG 2003-06-26 US disclosed
US-20020151637-A1 Polymeric structural support membrane CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2002-10-17 US disclosed
WO-2002070591-A2 POLYMERIC EXCAVATION STRUCTURAL SUPPORT MEMBRANE MBT HOLDING AG (CH) 2002-09-12 WO disclosed