SCHEMBL6748376

SCHEMBL6748376

CCCCCC1(CCCCC)CC1Br

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33
GAA P10253 2/20 0.32
EPHX2 P34913 1/20 0.32
CYP19A1 P11511 3/20 0.32
ALDH1A1 P00352 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
SCHEMBL8626986 0.67 GRIN2D (0.48) TSHRTHRBEPHX2ALDH1A1
SCHEMBL25338622 0.61 TSHR (0.41) TSHRTHRB
SCHEMBL5713369 0.61 TSHR (0.41) TSHRTHRBGAAALDH1A1
Hexane SCHEMBL5017645 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL8705498 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL9859565 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL9557662 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL357364 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL11650566 0.59 TSHR (0.88) TSHRTHRBALDH1A1
Hexane SCHEMBL399 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101828552-B Methods of blocking ethylene response in plants using cyclopropene derivatives UNIV NORTH CAROLINA STATE 2014-09-24 CN disclosed
CN-1450859-B Method for blocking ethylene response in plants using cyclopropene derivatives UNIV NORTH CAROLINA STATE 2011-08-03 CN disclosed
CN-101828552-A Method with the cyclopropene derivatives blocking ethylene response in plants UNIV NORTH CAROLINA STATE 2010-09-15 CN disclosed
EP-1233669-B1 BLOCKING AN ETHYLENE RESPONSE IN PLANTS USING CYCLOPROPENE DERIVATIVES UNIV NORTH CAROLINA STATE (US) 2004-02-25 EP disclosed
CN-1450859-A method for blocking ethylene response in plants using cyclopropene derivatives UNIV NORTH CAROLINA STATE (US) 2003-10-22 CN disclosed
EP-1233669-A2 BLOCKING AN ETHYLENE RESPONSE IN PLANTS USING CYCLOPROPENE DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2002-08-28 EP disclosed
US-6365549-B2 PRESERVATION NORTH CAROLINA STATE UNIVERSITY 2002-04-02 US disclosed
US-20010019995-A1 Methods of blocking an ethylene response in plants using cyclopropene derivatives NORTH CAROLINA STATE UNIVERSITY 2001-09-06 US disclosed
WO-2001037663-A2 BLOCKING AN ETHYLENE RESPONSE IN PLANTS USING CYCLOPROPENE DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2001-05-31 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-20010019995-A1 Methods of blocking an ethylene response in plants using cyclopropene derivatives PRUNE1, NOTUM, FAR1 TSHR 2454/4885THRB 1839/4885GAA 3622/4885

“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.