SCHEMBL2121111

SCHEMBL2121111

C=CCN(Cc1ccccc1C)Cc1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
TAAR1 Q96RJ0 1/20 0.41
BCHE P06276 4/20 0.39
ACHE P22303 1/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
HTR1D P28221 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR1E P28566 1/20 0.38

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
Hydrochloric Acid SCHEMBL933510 0.98 MAPT (0.53) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL11526249 0.96 MAPT (0.50) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL24894419 0.85 PYCR1 (0.47) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL189440 0.83 MAPT (0.60) MAPTLMNAKMT2AMEN1TAAR1
SCHEMBL11667015 0.81 ALDH1A1 (0.56) ALDH1A1LMNAHTTKMT2AMEN1
Water SCHEMBL20912805 0.81 MAPT (0.58) MAPTKMT2AMEN1TAAR1BCHE
Bromide SCHEMBL20912804 0.81 MAPT (0.58) MAPTKMT2AMEN1TAAR1BCHE
Hydrochloric Acid SCHEMBL859872 0.79 ESR1 (0.50) MAPTALDH1A1LMNAHTTBCHE
SCHEMBL18868170 0.79 ALDH1A1 (0.42) MAPTALDH1A1LMNAHTTKMT2A
SCHEMBL12677859 0.77 MAPT (0.70) MAPTALDH1A1LMNAHTTKMT2A

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
EP-3038468-B1 MICROBICIDAL AGENTS LANXESS DEUTSCHLAND GMBH (DE) 2017-08-16 EP claimed
EP-0252278-B1 Disinfecting agents and their use in disinfecting the skin and mucous membranes HENKEL KGAA (DE) 1998-08-19 EP claimed
EP-2512420-B1 USE OF 2,3-DIHYDROXYPROPYL DODECANOATE FOR TREATING SEBORRHEA FABRE PIERRE DERMO COSMETIQUE (FR) 2019-09-04 EP disclosed
US-9693560-B2 Microbicide substances LANXESS DEUTSCHLAND GMBH (DE) 2017-07-04 US disclosed
US-20160198712-A1 MICROBICIDE SUBSTANCES LANXESS DEUTSCHLAND GMBH (DE) 2016-07-14 US disclosed
US-8961944-B2 Use of delta-tocopheryl-carbohydrate as a depigmenting agent PIERRE FABRE DERMO-COSMETIQUE (FR) 2015-02-24 US disclosed
EP-2429485-B1 USE OF DELTA-TOCOPHERYL-CARBOHYDRATE AS A DEPIGMENTING AGENT PIERRE FABRE DERMO COSMÉTIQUE (FR) 2014-10-01 EP disclosed
EP-2509584-B1 PHARMACEUTICAL COMPOSITION FOR TREATING CUTANEOUS BURNS 45 SEC LLC (US) 2014-02-19 EP disclosed
US-20120093749-A1 USE OF DELTA-TOCOPHERYL-CARBOHYDRATE AS A DEPIGMENTING AGENT PIERRE FABRE DERMO-COSMETIQUE (FR) 2012-04-19 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-20120093749-A1 USE OF DELTA-TOCOPHERYL-CARBOHYDRATE AS A DEPIGMENTING AGENT TTPA, ECH1, GLA MAPT 1698/4885ALDH1A1 384/4885LMNA 668/4885

“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.