SCHEMBL3203124

SCHEMBL3203124

CC1=C(C)C(C)C(c2ccc3ccccc3c2C#N)=C1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 5/20 0.38
MAPT P10636 4/20 0.38
CYP1A2 P05177 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
GAA P10253 2/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
MYB P10242 1/20 0.33
CYP2C19 P33261 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
HSD17B10 Q99714 3/20 0.32
TSHR P16473 3/20 0.32
ALOX15 P16050 2/20 0.32
PIM1 P11309 2/20 0.32
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2A6 P11509 2/20 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
SCHEMBL3211136 0.80 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTCYP1A2MEN1
SCHEMBL3201189 0.75 ERN1 (0.45) ALDH1A1KDM4EMAPTCYP1A2KMT2A
SCHEMBL3210993 0.73 NCEH1 (0.35) CYP1A2MEN1KMT2ATSHRCYP2A6
SCHEMBL3201121 0.73 CYP1A2 (0.31) CYP1A2TSHRCYP2A6
SCHEMBL3197827 0.72 TSHR (0.42) ALDH1A1KDM4EGAAHPGDTSHR
SCHEMBL3203080 0.71 NPC1 (0.41) ALDH1A1KDM4EMAPTCYP1A2MEN1
SCHEMBL3201352 0.71 TAS1R3 (0.31)
Hydrochloric Acid SCHEMBL3206622 0.70 MEN1 (0.30) KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL3211561 0.70 DNMT1 (0.34) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL3211555 0.70 LMNA (0.37) ALDH1A1KDM4EMEN1KMT2AGAA

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 ALDH1A1 1229/4885KDM4E 4084/4885MAPT 2641/4885
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME C1R, C1S, AP1M1 ALDH1A1 1229/4885KDM4E 4084/4885MAPT 2641/4885

“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.