SCHEMBL3209511

SCHEMBL3209511

CCC(=O)c1cc(OC)ccc1C1=C(C)C(C)=C(C)C1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 3/20 0.37
ADORA3 P0DMS8 1/20 0.37
KMT2A Q03164 4/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
MEN1 O00255 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
HMGCR P04035 1/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL3204217 0.85 ALDH1A1 (0.45) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3191835 0.83 CHRNA7 (0.38) SMN1; SMN2KDM4ECYP2D6HTTKMT2A
SCHEMBL3212077 0.81 SMN1; SMN2 (0.39) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3191194 0.80 ALDH1A1 (0.51) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3203650 0.80 HSP90AB1 (0.37) SMN1; SMN2HTTNPC1RAB9AL3MBTL1
SCHEMBL3216609 0.79 MYC (0.35) SMN1; SMN2KDM4EHTTADORA3KMT2A
SCHEMBL3204848 0.78 PDK2 (0.38) SMN1; SMN2KDM4EHTTADORA3KMT2A
SCHEMBL28085535 0.75 NPC1 (0.53) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL27467332 0.75 SMN1; SMN2 (0.69) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3202765 0.74 ERN1 (0.47) KDM4ECYP1A2CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732643-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-08 US disclosed
US-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME HANAOKA HIDENORI 2010-02-25 US disclosed
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-20090054607-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same HANAOKA HIDENORI 2009-02-26 US disclosed
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed
US-20040242410-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-12-02 US disclosed
EP-1426379-A1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME Sumitomo Chemical Company, Limited (JP) 2004-06-09 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 (2 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-20090054607-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same C1R, C1S, AP1M1 SMN1; SMN2 3599/4885KDM4E 4084/4885CYP1A2 315/4885
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME C1R, C1S, AP1M1 SMN1; SMN2 3599/4885KDM4E 4084/4885CYP1A2 315/4885

“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.