SCHEMBL1453496

SCHEMBL1453496

CC(C)(C1C(c2ccccc2)=Cc2c(Br)cccc21)C1C(c2ccccc2)=Cc2c(Br)cccc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL2973975 0.79 ALDH1A1 (0.35) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1451812 0.79 ALDH1A1 (0.39) ALDH1A1MAPK1
SCHEMBL1453032 0.76 CYP1A2 (0.37) ALDH1A1
SCHEMBL4650828 0.75 ALDH1A1 (0.32) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1453397 0.75 RAB9A (0.37) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1452611 0.75 CYP11B1 (0.33)
SCHEMBL1451928 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1453390 0.74 ALDH1A1 (0.34) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL1451756 0.73
SCHEMBL1451930 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7910783-B2 Preparation of substituted bridged indenyl and related ligands EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-03-22 US disclosed
EP-1971621-A1 PREPARATION OF SUBSTITUTED BRIDGED INDENYL AND RELATED LIGANDS ExxonMobil Chemical Patents Inc. (US) 2008-09-24 EP disclosed
WO-2007070045-A1 PREPARATION OF SUBSTITUTED BRIDGED INDENYL AND RELATED LIGANDS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2007-06-21 WO disclosed
US-20070135596-A1 Preparation of substituted bridged indenyl and related ligands 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-20070135596-A1 Preparation of substituted bridged indenyl and related ligands SP1, TTL, TTLL12 ALDH1A1 2182/4885MAPK1 2473/4885NPC1 1782/4885

“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.