SCHEMBL3201131

SCHEMBL3201131

CC1=C(C)C(C)=C(c2ccccc2C(=O)c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.44
CYP2C9 P11712 2/20 0.42
CYP2C8 P10632 1/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 1/20 0.39
MYC P01106 1/20 0.38
BCL2 P10415 1/20 0.38
MCL1 Q07820 1/20 0.38
ELANE P08246 1/20 0.38
MAPK14 Q16539 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3203358 0.85 HTT (0.46) CYP2C9CYP2C8MAPTALDH1A1KMT2A
SCHEMBL3203201 0.84 CYP2C8 (0.43) AKR1C3CYP2C9CYP2C8GAAMAPT
SCHEMBL3191753 0.82 TDP1 (0.47) AKR1C3CYP2C9CYP2C8MAPTPOLB
SCHEMBL3204479 0.82 ALDH1A1 (0.53) CYP2C9CYP2C8GAAMAPTPOLB
SCHEMBL3205879 0.77 AKR1C3 (0.43) AKR1C3CYP2C9CYP2C8GAAMAPT
SCHEMBL3193168 0.77 AKR1C3 (0.43) AKR1C3CYP2C9CYP2C8GAAMAPT
SCHEMBL3207144 0.76 NPC1 (0.42) CYP2C9CYP2C8GAAMAPTALDH1A1
SCHEMBL934811 0.75 AKR1C3 (0.67) AKR1C3CYP2C9CYP2C8GAAMAPT
SCHEMBL3205295 0.75 AKR1C3 (0.44) AKR1C3CYP2C9CYP2C8GAAMAPT
SCHEMBL31563669 0.74 MYC (0.56) AKR1C3CYP2C9GAAMAPTALDH1A1

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 AKR1C3 100/4885CYP2C9 1113/4885CYP2C8 1983/4885
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME C1R, C1S, AP1M1 AKR1C3 100/4885CYP2C9 1113/4885CYP2C8 1983/4885

“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.