SCHEMBL14877005

SCHEMBL14877005

[CH2]OCCc1ccccc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.60
SIGMAR1 Q99720 1/20 0.53
AOC3 Q16853 1/20 0.53
KCNH2 Q12809 1/20 0.51
IDO1 P14902 2/20 0.50
HRH3 Q9Y5N1 1/20 0.50
ABCB1 P08183 1/20 0.49
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
CHRM2 P08172 2/20 0.48
CHRM1 P11229 2/20 0.48
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
CA5A P35218 1/20 0.47
CHRM3 P20309 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL792023 0.83 TAAR1 (0.64) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL9190330 0.83 TAAR1 (0.64) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL28858018 0.83 TAAR1 (0.75) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL515187 0.79 IDO1 (0.64) TAAR1SIGMAR1AOC3IDO1ABCB1
SCHEMBL840064 0.79 TAAR1 (0.64) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL7831226 0.79 TAAR1 (0.69) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL9854725 0.77 TAAR1 (0.56) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL29467401 0.77 TAAR1 (0.67) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL158584 0.77 TAAR1 (0.67) TAAR1SIGMAR1AOC3KCNH2IDO1
SCHEMBL399492 0.76 TAAR1 (0.60) TAAR1SIGMAR1AOC3KCNH2IDO1

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
EP-2591673-A1 PEST CONTROL AGENT Meiji Seika Pharma Co., Ltd. (JP) 2013-05-15 EP disclosed
US-20130102637-A1 PEST CONTROL AGENT GIFU UNIVERSITY (JP) 2013-04-25 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-20130102637-A1 PEST CONTROL AGENT DDT, PIR, ITPR2 TAAR1 921/4885SIGMAR1 3525/4885AOC3 1853/4885

“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.