SCHEMBL21153741

SCHEMBL21153741

C#CN(CCc1ccc(F)cc1)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.44
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PYCR1 P32322 2/20 0.42
AOC3 Q16853 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KCNH2 Q12809 2/20 0.41
KCNA5 P22460 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL4551293 0.76 ALDH1A1 (0.60) LMNAGAAPYCR1AOC3ALDH1A1
SCHEMBL5542194 0.74 KCNA5 (0.50) LMNAPYCR1ALDH1A1KCNA5KMT2A
SCHEMBL12128225 0.72 L3MBTL1 (0.56) TAAR1KDM4EAOC3KCNH2L3MBTL1
SCHEMBL12128173 0.72 L3MBTL1 (0.56) TAAR1KDM4EAOC3KCNH2L3MBTL1
SCHEMBL654154 0.72 TAAR1 (0.56) TAAR1KDM4ELMNAALDH1A1KCNH2
SCHEMBL7326431 0.72 ALDH1A1 (0.50) TAAR1AOC3ALDH1A1KMT2AMEN1
SCHEMBL16226366 0.71 KCNH2 (0.55) KCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL30274293 0.71 L3MBTL1 (0.50) TAAR1KDM4ELMNAGAAAOC3
SCHEMBL4550659 0.70 ALDH1A1 (0.52) KDM4ELMNAGAAPYCR1AOC3
SCHEMBL21153738 0.69 GAA (0.53) TAAR1KDM4ELMNAGAAALDH1A1

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-20210052519-A1 Small molecule drugs and related methods for treatment of diseases related to tdo-43, alpha-synuclein, huntingtin's protein and tau protein oligomer formation ACELOT,INC (US) 2021-02-25 US disclosed
US-20200223788-A1 SMALL MOLECULE DRUGS AND RELATED METHODS FOR TREATMENT OF DISEASES RELATED TO ABETA42 OLIGOMER FORMATION ACELOT, INC. 2020-07-16 US disclosed
US-10703711-B2 Small molecule drugs and related methods for treatment of diseases related to Aβ42 oligomer formation ACELOT, INC. (US) 2020-07-07 US disclosed
US-20190210959-A1 Small molecule drugs and related methods for treatment of diseases related to abeta42 oligomer formation ACELOT, INC. 2019-07-11 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 (4 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-20190210959-A1 Small molecule drugs and related methods for treatment of diseases related to abeta42 oligomer formation APP, PSEN2, PSEN1 TAAR1 2452/4885KDM4E 4863/4885LMNA 635/4885
US-10703711-B2 Small molecule drugs and related methods for treatment of diseases related to Aβ42 oligomer formation APP, PSEN2, PSEN1 TAAR1 1901/4885KDM4E 4816/4885LMNA 571/4885
US-20200223788-A1 SMALL MOLECULE DRUGS AND RELATED METHODS FOR TREATMENT OF DISEASES RELATED TO ABETA42 OLIGOMER FORMATION APP, PSEN2, PSEN1 TAAR1 2452/4885KDM4E 4863/4885LMNA 635/4885
US-20210052519-A1 Small molecule drugs and related methods for treatment of diseases related to tdo-43, alpha-synuclein, huntingtin's protein and tau protein oligomer formation HTT, TARDBP, SNCA TAAR1 1767/4885KDM4E 4369/4885LMNA 1330/4885

“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.