SCHEMBL2563224

SCHEMBL2563224

COc1ccc(CCCC2=CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.61
TAAR1 Q96RJ0 1/20 0.52
SIGMAR1 Q99720 2/20 0.50
IGF1R P08069 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX5 P09917 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
MAOB P27338 2/20 0.47
ESR1 P03372 1/20 0.46
CYP19A1 P11511 1/20 0.46
ESR2 Q92731 1/20 0.46
AOC3 Q16853 1/20 0.46

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
SCHEMBL2562715 0.88 TAAR1 (0.55) CALM1TAAR1SIGMAR1HRH3MAOB
SCHEMBL244070 0.85 CALM1 (0.79) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL4254058 0.81 CALM1 (0.72) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL11007798 0.79 CALM1 (0.69) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL10571532 0.79 CALM1 (0.69) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL9509173 0.79 CALM1 (0.69) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL17400406 0.79 CALM1 (0.69) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL2562583 0.78 LTA4H (0.57) TAAR1SIGMAR1ALOX15
SCHEMBL5632470 0.78 LTA4H (0.69) CALM1TAAR1SIGMAR1IGF1RALOX15
SCHEMBL834551 0.76 TAAR1 (0.73) CALM1TAAR1SIGMAR1HRH3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9072293-B2 Cyclopropenes and method for applying cyclopropenes to agricultural products or crops ERUM BIOTECHNOLOGIES INC. (KR) 2015-07-07 US disclosed
CN-102843906-B Cyclopropene compounds and methods of adding the compounds to agricultural crops ERUM BIOTECHNOLOGIES INC 2015-07-01 CN disclosed
EP-2561754-A2 CYCLOPROPENE COMPOUND, AND METHOD FOR ADDING SAME TO CROPS Erum Biotechnologies Inc. (KR) 2013-02-27 EP disclosed
CN-102843906-A Cyclopropene compounds and methods of adding the compounds to agricultural crops ERUM BIOTECHNOLOGIES INC 2012-12-26 CN disclosed
US-20120322662-A1 CYCLOPROPENES AND METHOD FOR APPLYING CYCLOPROPENES TO AGRICULTURAL PRODUCTS OR CROPS ERUM BIOTECHNOLOGIES INC. (KR) 2012-12-20 US disclosed
WO-2011132888-A2 CYCLOPROPENE COMPOUND, AND METHOD FOR ADDING SAME TO CROPS (주) 이룸바이오테크놀러지 (KR) 2011-10-27 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-20120322662-A1 CYCLOPROPENES AND METHOD FOR APPLYING CYCLOPROPENES TO AGRICULTURAL PRODUCTS OR CROPS GLA, PFAS, AMY1A CALM1 1010/4885TAAR1 2784/4885SIGMAR1 4473/4885

“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.