SCHEMBL1270041

SCHEMBL1270041

C=CC=CC=C(C)CCO

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 1/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
PGR P06401 1/20 0.35

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
SCHEMBL14160212 1.00 SQLE (0.35) SQLENR1I2LMNAPGR
SCHEMBL8298805 0.86 SQLE (0.39) SQLENR1I2LMNAPGR
SCHEMBL12970379 0.85 SQLE (0.41) SQLENR1I2LMNAPGR
SCHEMBL11593052 0.82
SCHEMBL11593053 0.82
SCHEMBL14256141 0.80
SCHEMBL10238369 0.80
SCHEMBL13716618 0.79 NR1I2 (0.34) NR1I2LMNAPGR
SCHEMBL10282937 0.79 NR1I2 (0.34) NR1I2LMNAPGR
SCHEMBL16317378 0.76 NR1I2 (0.36) NR1I2LMNAPGR

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-20110046422-A1 FUEL COMPOSITIONS COMPRISING ISOPRENE DERIVATIVES DANISCO US INC. 2011-02-24 US disclosed
US-20110040058-A1 POLYMERIZATION OF ISOPRENE FROM RENEWABLE RESOURCES THE GOODYEAR TIRE & RUBBER COMPANY 2011-02-17 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-20110046422-A1 FUEL COMPOSITIONS COMPRISING ISOPRENE DERIVATIVES GGPS1, FNTA, COASY SQLE 9/4885NR1I2 1678/4885LMNA 1811/4885

“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.