SCHEMBL13582000

SCHEMBL13582000

C#Cc1ccc(C2=C(c3ccc(C#Cc4ccccc4)cc3)C(=O)C(c3ccccc3)=C2c2ccc(Oc3ccc(C4=C(c5ccccc5)C(=O)C(c5ccc(C#Cc6ccccc6)cc5)=C4c4ccc(C#C)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.39
GSTP1 P09211 1/20 0.38
MMP2 P08253 2/20 0.38
MMP3 P08254 2/20 0.38
MMP13 P45452 2/20 0.38
HAO1 Q9UJM8 2/20 0.36
SLK Q9H2G2 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GRM5 P41594 1/20 0.35
ACACB O00763 1/20 0.34
PTPRC P08575 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPN6 P29350 1/20 0.34
PTPN9 P43378 1/20 0.34

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
SCHEMBL13582297 1.00 FFAR1 (0.39) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13581991 0.99 FFAR1 (0.40) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13581998 0.99 FFAR1 (0.40) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13582120 0.99 FFAR1 (0.40) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL23380165 0.94 GSTP1 (0.42) GSTP1HAO1SLKHSP90AA1HSP90AB1
SCHEMBL13586765 0.93 GSTP1 (0.41) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13586795 0.93 GSTP1 (0.41) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13586764 0.93 GSTP1 (0.41) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13586758 0.93 GSTP1 (0.41) FFAR1GSTP1MMP2MMP3MMP13
SCHEMBL13586792 0.93 GSTP1 (0.41) FFAR1GSTP1MMP2MMP3MMP13

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-7626059-B2 Multifunctional ethynyl substituted monomers and polyarylene compositions therefrom DOW GLOBAL TECHNOLOGIES INC. 2009-12-01 US disclosed
US-20090012193-A1 Multifunctional Ethynyl Substituted Monomers and Polyarylene Compositions Therefrom DOW GLOBAL TECHNOLOGIES LLC 2009-01-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090012193-A1 Multifunctional Ethynyl Substituted Monomers and Polyarylene Compositions Therefrom WEE2, WASF2, WEE1 FFAR1 1249/4885GSTP1 753/4885MMP2 4471/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.