SCHEMBL2969468

SCHEMBL2969468

CC1=CCc2cc(Br)c(-c3ccccc3C)cc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
CD274 Q9NZQ7 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
DHFR P00374 1/20 0.31
HTR7 P34969 1/20 0.31
PLA2G7 Q13093 2/20 0.31
GRIA1 P42261 1/20 0.31
CACNG8 Q8WXS5 1/20 0.31
NPC1 O15118 2/20 0.30
CASP3 P42574 2/20 0.30
RAB9A P51151 2/20 0.30
SENP8 Q96LD8 2/20 0.30
SENP7 Q9BQF6 2/20 0.30
SENP6 Q9GZR1 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL2974247 0.94 ALDH1A1 (0.35) ALDH1A1CD274MAOAMAOBDHFR
SCHEMBL2973351 0.88 MAOA (0.33) CD274MAOAMAOB
SCHEMBL2962314 0.82 ALDH1A1 (0.38) ALDH1A1MAOB
SCHEMBL2973639 0.82 CA12 (0.38) ALDH1A1MAOAMAOBDHFRHTR7
SCHEMBL2971823 0.81 MAOA (0.33) MAOAMAOB
SCHEMBL13319611 0.78 ALDH1A1 (0.50) ALDH1A1MAOAMAOBDHFRHTR7
SCHEMBL2963564 0.77 BCHE (0.35)
SCHEMBL2962764 0.76 CA12 (0.38) ALDH1A1MAOAMAOBDHFRHTR7
SCHEMBL2969466 0.75 ALDH1A1 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2957256 0.75 ALDH1A1 (0.38) ALDH1A1MAOB

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 3 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
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 WO 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 4332/4885CD274 225/4885MAOA 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.