SCHEMBL2964692

SCHEMBL2964692

Brc1ccccc1C1=[C]CC=C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PBRM1 Q86U86 1/20 0.32
IDO1 P14902 1/20 0.32
LMNA P02545 1/20 0.32
GALR1 P47211 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MPI P34949 1/20 0.31
DCUN1D1 Q96GG9 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL2971131 0.76 NISCH (0.34) ALDH1A1IDO1GALR1KDM4EMAPT
SCHEMBL9343722 0.72 CA1 (0.36) LMNAHPGD
SCHEMBL816149 0.69 PNMT (0.44) ALDH1A1MAOALMNAKDM4EMAPT
SCHEMBL2971380 0.69 TRPA1 (0.33)
SCHEMBL31295703 0.67 ALDH1A1 (0.67) ALDH1A1MAPK1MAOAMAOBPBRM1
SCHEMBL358976 0.67 ALDH1A1 (0.67) ALDH1A1MAPK1MAOAMAOBPBRM1
SCHEMBL31465796 0.64 ALDH1A1 (0.63) ALDH1A1MAPK1MAOAMAOBPBRM1
SCHEMBL7519287 0.64 ALDH1A1 (0.63) ALDH1A1MAPK1MAOAMAOBPBRM1
SCHEMBL2966446 0.62 ALDH1A1 (0.39) ALDH1A1MAOAKDM4EMAPTHPGD
Bromide SCHEMBL6343983 0.62 ALDH1A1 (0.60) ALDH1A1MAPK1MAOAMAOBPBRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US 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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 ALDH1A1 4332/4885MAPK1 3118/4885MAOA 958/4885

“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.