SCHEMBL320624

SCHEMBL320624

CCCCC1=C(CCCC)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.54
TSHR P16473 4/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.35
ALDH1A1 P00352 4/20 0.35
TP53 P04637 1/20 0.35
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
HPGD P15428 2/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL3802053 0.90 SCD (0.64) SCDTSHRLMNATHRBALDH1A1
SCHEMBL7753696 0.88 SCD (0.68) SCDTSHRLMNATHRBALDH1A1
SCHEMBL11238492 0.88 SCD (0.68) SCDTSHRLMNATHRBALDH1A1
SCHEMBL6283167 0.85 SCD (0.43) SCDTSHRLMNATHRBALDH1A1
SCHEMBL5365766 0.85 SCD (0.43) SCDTSHRLMNATHRBALDH1A1
SCHEMBL7749957 0.83 SCD (0.52) SCDTSHRTHRBALDH1A1
SCHEMBL10447160 0.81
SCHEMBL10985090 0.79 SCD (0.53) SCDTSHRLMNATHRBALDH1A1
SCHEMBL7754788 0.78 SCD (0.92) SCDTSHRLMNAALDH1A1NPSR1
SCHEMBL7754017 0.78 TSHR (0.58) SCDTSHRLMNAALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2173691-B1 METHODS OF INHIBITING ETHYLENE RESPONSES IN PLANTS USING CYCLOPROPENE AMINE COMPOUNDS UNIV NORTH CAROLINA STATE (US) 2013-11-13 EP disclosed
US-20130137575-A1 CYCLOPROPENE AMINE COMPOUNDS NORTH CAROLINA STATE UNIVERSITY (US) 2013-05-30 US disclosed
US-8329954-B2 Cyclopropene amine compounds NORTH CAROLINA STATE UNIVERSITY (US) 2012-12-11 US disclosed
US-20120035269-A1 CYCLOPROPENE AMINE COMPOUNDS SISLER EDWARD C (US) 2012-02-09 US disclosed
US-8093430-B2 Methods of inhibiting ethylene responses in plants using cyclopropene amine compounds NORTH CAROLINA STATE UNIVERSITY (US) 2012-01-10 US disclosed
EP-2173691-A1 METHODS OF INHIBITING ETHYLENE RESPONSES IN PLANTS USING CYCLOPROPENE AMINE COMPOUNDS North Carolina State University (US) 2010-04-14 EP disclosed
US-20090124504-A1 METHODS OF INHIBITING ETHYLENE RESPONSES IN PLANTS USING CYCLOPROPENE AMINE COMPOUNDS NORTH CAROLINA STATE UNIVERSITY 2009-05-14 US disclosed
WO-2009002407-A1 METHODS OF INHIBITING ETHYLENE RESPONSES IN PLANTS USING CYCLOPROPENE AMINE COMPOUNDS NORTH CAROLINA STATE UNIVERSITY (US) 2008-12-31 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 (3 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-20120035269-A1 CYCLOPROPENE AMINE COMPOUNDS PNMT, EDNRB, CNR1 SCD 2174/4885TSHR 1062/4885LMNA 4451/4885
US-20130137575-A1 CYCLOPROPENE AMINE COMPOUNDS PNMT, EDNRB, CNR1 SCD 2174/4885TSHR 1062/4885LMNA 4451/4885
US-20090124504-A1 METHODS OF INHIBITING ETHYLENE RESPONSES IN PLANTS USING CYCLOPROPENE AMINE COMPOUNDS EDNRB, EDNRA, ECE1 SCD 1687/4885TSHR 1206/4885LMNA 4537/4885

“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.