SCHEMBL19970469

SCHEMBL19970469

CCCCN(CCC[Si](OC)(OC)OC)C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA9 Q16790 3/20 0.41
LMNA P02545 3/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 3/20 0.33
ALDH2 P05091 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
EPHX1 P07099 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
SCHEMBL22477356 0.93 LMNA (0.36) CA12CA1CA9LMNAMMP1
SCHEMBL19775776 0.93 LMNA (0.32) LMNA
SCHEMBL20467882 0.81
SCHEMBL22574055 0.81 CA12 (0.38) CA12CA1CA9LMNAMMP1
SCHEMBL19821143 0.81 LMNA (0.30) LMNA
SCHEMBL1132899 0.81 MTNR1A (0.39) CYP1A2MAPK1KDM4E
SCHEMBL16422593 0.80 CA12 (0.37) CA12CA1CA9LMNAMMP1
SCHEMBL497913 0.80 CA12 (0.58) CA12CA1CA9MMP1MMP2
SCHEMBL19929282 0.80 EPHX1 (0.39) CA12CA1CA9LMNAMMP1
SCHEMBL19929284 0.79 EPHX1 (0.45) CA12CA1CA9LMNAEPHX1

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
US-20180162959-A1 MODIFIED AND CONJUGATED DIENE-BASED POLYMER AND METHOD FOR PREPARING THEREOF LG CHEM, LTD. (KR) 2018-06-14 US claimed
EP-3296323-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR LG Chem, Ltd. (KR) 2018-03-21 EP claimed
EP-3296323-B1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR LG CHEMICAL LTD (KR) 2020-09-30 EP disclosed
US-10604591-B2 Modified and conjugated diene-based polymer and method for preparing thereof LG CHEM, LTD. (KR) 2020-03-31 US disclosed
US-10604591-B2 Modified and conjugated diene-based polymer and method for preparing thereof LG CHEM, LTD. (KR) 2020-03-31 US disclosed
US-20180162959-A1 MODIFIED AND CONJUGATED DIENE-BASED POLYMER AND METHOD FOR PREPARING THEREOF LG CHEM, LTD. (KR) 2018-06-14 US disclosed
US-20180162959-A1 MODIFIED AND CONJUGATED DIENE-BASED POLYMER AND METHOD FOR PREPARING THEREOF LG CHEM, LTD. (KR) 2018-06-14 US disclosed
US-20180162959-A1 MODIFIED AND CONJUGATED DIENE-BASED POLYMER AND METHOD FOR PREPARING THEREOF LG CHEM, LTD. (KR) 2018-06-14 US disclosed
EP-3296323-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR LG Chem, Ltd. (KR) 2018-03-21 EP disclosed
EP-3296323-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR LG Chem, Ltd. (KR) 2018-03-21 EP 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-10604591-B2 Modified and conjugated diene-based polymer and method for preparing thereof RIF1, TRRAP, RAD51 CA12 3722/4885CA1 3762/4885CA9 2950/4885

“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.