SCHEMBL2959780

SCHEMBL2959780

Cc1cc2c(C3C=Cc4ccccc43)cccc2cc1Br

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2A6 P11509 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
SCHEMBL2960983 0.94 TDP1 (0.31) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL2959814 0.85 MAOA (0.31) ALDH1A1
SCHEMBL2971830 0.85 CYP1A2 (0.42) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL2964360 0.84 SIGMAR1 (0.31) ALDH1A1
SCHEMBL2970232 0.82 MAOA (0.31) ALDH1A1
SCHEMBL2972562 0.82 CYP1A2 (0.39) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL2962076 0.81 SIGMAR1 (0.31) ALDH1A1
SCHEMBL2968703 0.81 CYP2A6 (0.36) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL2962466 0.81 CYP2A6 (0.36) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL4282479 0.81 ALDH1A1 (0.35) CYP1A2ALDH1A1HSD17B10

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 CYP1A2 2409/4885ALDH1A1 4332/4885HPGD 4720/4885

“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.