SCHEMBL1453097

SCHEMBL1453097

CC1=Cc2ccc(N(C)C)cc2C1C(C)(C)C1C(C)=Cc2ccc(N(C)C)cc21

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TERT O14746 1/20 0.32
APP P05067 1/20 0.32
MAPT P10636 1/20 0.30
PSMB5 P28074 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
SCHEMBL1452656 0.75 ALDH1A1 (0.33) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1453356 0.75 ALDH1A1 (0.33) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL4650831 0.73 ALDH1A1 (0.32) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1453748 0.73 TERT (0.35) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1452327 0.73 CA1 (0.36) TERT
SCHEMBL1452244 0.73 ALDH1A1 (0.34) ALDH1A1HSD17B10APPMAPT
SCHEMBL1454406 0.70 KIF11 (0.40) MAPT
SCHEMBL1453589 0.69 CYP3A4 (0.35)
SCHEMBL1451790 0.64 MEN1 (0.30)
SCHEMBL1453726 0.63 PDK2 (0.34)

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 2182/4885TSHR 47/4885ALOX15 4554/4885

“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.