SCHEMBL2256263

SCHEMBL2256263

CCOCCCOC(=O)C(C)CC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 4/20 0.42
THRB P10828 1/20 0.37
HPGD P15428 2/20 0.34
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL28440833 0.96 TSHR (0.42) TSHRALDH1A1THRBHPGDHTT
SCHEMBL20465909 0.94 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL805575 0.88 ALDH1A1 (0.56) TSHRALDH1A1THRBHSD17B10SMN1; SMN2
SCHEMBL10033506 0.86 TSHR (0.54) TSHRALDH1A1THRBHSD17B10
SCHEMBL19798141 0.86 TSHR (0.54) TSHRALDH1A1THRBHSD17B10
SCHEMBL12259379 0.86 TSHR (0.54) TSHRALDH1A1THRBHSD17B10
SCHEMBL2759388 0.85 MAPT (0.35) TSHRALDH1A1HSD17B10ATM
SCHEMBL2759384 0.85 CYP4F2 (0.39) TSHRALDH1A1THRBHTTHSD17B10
SCHEMBL12200848 0.85 MAPT (0.35) TSHRALDH1A1HSD17B10ATM
SCHEMBL13926739 0.85 CYP4F2 (0.39) TSHRALDH1A1THRBHTTHSD17B10

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-8716182-B2 Liquid aqueous crop protection formulations BASF SE (DE) 2014-05-06 US disclosed
US-20110195839-A1 Liquid Aqueous Crop Protection Formulations BASF SE (DE) 2011-08-11 US disclosed
EP-2348833-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-08-03 EP disclosed
WO-2010040834-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 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-20110195839-A1 Liquid Aqueous Crop Protection Formulations AQP1, GANC, BROX TSHR 4639/4885ALDH1A1 2866/4885THRB 4832/4885

“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.