SCHEMBL867197

SCHEMBL867197

C=C(C(=O)O)C(CCC)CC1CO1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
NFKB1 P19838 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GRIK1 P39086 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 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
SCHEMBL2186213 0.90 CA2 (0.41) ALDH1A1GRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL867646 0.88 ALDH1A1 (0.40) ALDH1A1GRIK1SLC1A2SLC1A1GRIK2
SCHEMBL3667634 0.86 ALDH1A1 (0.36) ALDH1A1
SCHEMBL15771 0.86 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10893611 0.85 ALDH1A1 (0.30) ALDH1A1
SCHEMBL7269547 0.80
Acrylic Acid SCHEMBL7619967 0.80 ALOX15 (0.33) ALDH1A1
SCHEMBL8646081 0.80 ALDH1A1 (0.37) ALDH1A1
SCHEMBL5139153 0.79 ALDH1A1 (0.36) ALDH1A1
SCHEMBL3820321 0.78 HDAC1 (0.56) CHRM1AKR1A1CHRM3HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273324-B2 Polyvinylamide polymers containing polymerizable functionalities ISP INVESTMENTS LLC (US) 2019-04-30 US disclosed
US-9487609-B2 Premixes suitable for the production of membrane materials ISP INVESTMENTS LLC (US) 2016-11-08 US disclosed
US-20160280826-A1 Polyvinylamide Polymers Containing Polymerizable Functionalities PHARMACHEM LABORATORIES LLC 2016-09-29 US disclosed
US-9290721-B2 Visually perceivable image-forming dye scavenging article ISP INVESTMENTS INC. (US) 2016-03-22 US disclosed
US-20130303431-A1 VISUALLY PERCEIVABLE IMAGE-FORMING DYE SCAVENGING ARTICLE ISP INVESTMENTS INC. (US) 2013-11-14 US disclosed
US-20120220741-A1 POLYVINYLAMIDE POLYMERS CONTAINING POLYMERIZABLE FUNCTIONALITIES ISP INVESTMENTS INC. (US) 2012-08-30 US disclosed
US-8242224-B2 Polyvinylamide polymers containing polymerizable functionalities ISP INVESTMENTS INC. (US) 2012-08-14 US disclosed
WO-2012078950-A1 A VISUALLY PERCEIVABLE IMAGE-FORMING DYE SCAVENGING ARTICLE ISP INVESTMENTS INC. (US) 2012-06-14 WO disclosed
US-20120077893-A1 Premixes Suitable for the Production of Membrane Materials ISP INVESTMENTS INC. (US) 2012-03-29 US disclosed
US-20110245409-A1 Polyvinylamide Polymers Containing Polymerizable Functionalities ASHLAND LICENSING AND INTELLECTUAL PROPERTY LLC 2011-10-06 US disclosed
WO-2010111607-A1 PREMIXES SUITABLE FOR THE PRODUCTION OF MEMBRANE MATERIALS ISP INVESTMENTS INC. (US) 2010-09-30 WO disclosed
US-20100190947-A1 POLYVINYLAMIDE POLYMERS CONTAINING POLYMERIZABLE FUNCTIONALITIES ISP INVESTMENTS LLC 2010-07-29 US disclosed
EP-2201051-A1 POLYVINYLAMIDE POLYMERS CONTAINING POLYMERIZABLE FUNCTIONALITIES Isp Investments Inc. (US) 2010-06-30 EP disclosed
WO-2009023843-A1 POLYVINYLAMIDE POLYMERS CONTAINING POLYMERIZABLE FUNCTIONALITIES ISP INVESTMENTS INC. (US) 2009-02-19 WO disclosed