SCHEMBL6881981

SCHEMBL6881981

[CH2]CN1C(=O)C=C(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RGS4 P49798 2/20 0.32
XPO1 O14980 2/20 0.32
ALDH1A1 P00352 2/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL4395914 0.81 MGLL (0.33) RGS4XPO1ALDH1A1GMNNLMNA
SCHEMBL11805906 0.81 XPO1 (0.33) RGS4XPO1ALDH1A1GMNNLMNA
SCHEMBL4011867 0.79 ALDH1A1 (0.48) RGS4XPO1ALDH1A1GMNNLMNA
SCHEMBL8883684 0.77 MGLL (0.46) ALDH1A1LMNAMAPTNPSR1MGLL
SCHEMBL8885500 0.77 MGLL (0.41) ALDH1A1LMNAMAPTNPSR1MGLL
SCHEMBL8443692 0.77 CASP3 (0.44) ALDH1A1MAPTNPSR1
SCHEMBL8443620 0.76 MGLL (0.48) ALDH1A1LMNAMAPTNPSR1MGLL
SCHEMBL2786847 0.76 PTGS1 (0.36) ALDH1A1GMNNLMNAMAPTTHPO
SCHEMBL8885012 0.76 MGLL (0.48) ALDH1A1LMNAMAPTNPSR1MGLL
SCHEMBL907802 0.76 MGLL (0.48) ALDH1A1LMNAMAPTNPSR1MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10093762-B2 Process for modifying polymers AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2018-10-09 US claimed
US-20180155480-A1 PROCESS FOR MODIFYING POLYMERS WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2018-06-07 US claimed
EP-3286253-A1 PROCESS FOR MODIFYING POLYMERS Akzo Nobel Chemicals International B.V. (NL) 2018-02-28 EP claimed
US-9688783-B2 Process for modifying ethylene-based polymers and copolymers AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2017-06-27 US claimed
US-20160347876-A1 Process for Modifying Ethylene-Based Polymers and Copolymers WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2016-12-01 US claimed
WO-2016170018-A1 PROCESS FOR MODIFYING POLYMERS AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2016-10-27 WO claimed
US-20040241706-A1 Highly specific modulators of GTPases for target validation IRM, LLC 2004-12-02 US claimed
WO-2004024082-A2 HIGHLY SPECIFIC MODULATORS OF GTPASES FOR TARGET VALIDATION IRM, LLC (GB) 2004-03-25 WO claimed
US-10093762-B2 Process for modifying polymers AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2018-10-09 US disclosed
US-20180155480-A1 PROCESS FOR MODIFYING POLYMERS WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2018-06-07 US disclosed
US-20180086887-A1 PROCESS FOR CROSSLINKING POLYPROPYLENE WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2018-03-29 US disclosed
EP-3286253-A1 PROCESS FOR MODIFYING POLYMERS Akzo Nobel Chemicals International B.V. (NL) 2018-02-28 EP disclosed
US-9688783-B2 Process for modifying ethylene-based polymers and copolymers AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2017-06-27 US disclosed
US-20160347876-A1 Process for Modifying Ethylene-Based Polymers and Copolymers WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2016-12-01 US disclosed
WO-2016170018-A1 PROCESS FOR MODIFYING POLYMERS AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2016-10-27 WO disclosed
EP-3066151-A1 PROCESS FOR MODIFYING ETHYLENE-BASED POLYMERS AND COPOLYMERS Akzo Nobel Chemicals International B.V. (NL) 2016-09-14 EP disclosed
WO-2015067533-A1 PROCESS FOR MODIFYING ETHYLENE-BASED POLYMERS AND COPOLYMERS AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2015-05-14 WO disclosed
US-20040241706-A1 Highly specific modulators of GTPases for target validation IRM, LLC 2004-12-02 US disclosed
WO-2004024082-A2 HIGHLY SPECIFIC MODULATORS OF GTPASES FOR TARGET VALIDATION IRM, LLC (GB) 2004-03-25 WO 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-20040241706-A1 Highly specific modulators of GTPases for target validation CDC42, ARHGDIB, ARHGEF2 RGS4 94/4885XPO1 1839/4885ALDH1A1 4883/4885

“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.