SCHEMBL3679002

SCHEMBL3679002

CC(C)(C)C(=N)c1ccccc1-c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 3/20 0.44
HTR7 P34969 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PNMT P11086 1/20 0.42
HSP90AA1 P07900 2/20 0.36
PGR P06401 1/20 0.34
DRD2 P14416 2/20 0.34
DRD4 P21917 2/20 0.34
DRD3 P35462 2/20 0.34
ALDH1A1 P00352 2/20 0.33
PPARG P37231 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3681402 0.84 NPC1 (0.40) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL3679790 0.82 NPC1 (0.36) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL3676607 0.79 HTR7 (0.46) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL3676091 0.78 NPC1 (0.40) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL524602 0.76 PNMT (0.63) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL30103334 0.76 PNMT (0.63) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL3682156 0.76 PNMT (0.42) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL3674178 0.76 PNMT (0.42) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL21758198 0.75 HSP90AA1 (0.56) HTR2BHTR7NPC1RAB9APNMT
SCHEMBL28635892 0.75 HTR2B (0.59) HTR2BHTR7NPC1RAB9APNMT

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 5 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-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
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-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 HTR2B 2177/4885HTR7 3440/4885NPC1 2173/4885
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME C1R, C1S, AP1M1 HTR2B 2177/4885HTR7 3440/4885NPC1 2173/4885

“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.