SCHEMBL2232026

SCHEMBL2232026

OCC(O)CC1CCCCN1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.53
MEN1 O00255 2/20 0.53
LMNA P02545 2/20 0.53
TP53 P04637 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 1/20 0.53
CYP1A2 P05177 1/20 0.53
TSHR P16473 1/20 0.53
MLNR O43193 1/20 0.53
ABCB11 O95342 1/20 0.53
EGFR P00533 1/20 0.53
FYN P06241 1/20 0.53
CHRM2 P08172 1/20 0.53
CHRM4 P08173 1/20 0.53
HTR1A P08908 1/20 0.53
CHRM5 P08912 1/20 0.53
ADRA2A P08913 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
CHRM1 P11229 1/20 0.53
ADRA2B P18089 1/20 0.53

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
SCHEMBL2229582 0.94 FDPS (0.46) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL11705851 0.85 CYP2D6 (0.50) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL29507344 0.79 SLC6A2 (0.49) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL15594567 0.78 CYP2D6 (0.52) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL11657826 0.78 FDPS (0.47) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL31318430 0.78 CYP2D6 (0.55) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL456091 0.78 CYP2D6 (0.55) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL2231729 0.77 ALDH1A1 (0.35) LMNAALDH1A1MAPT
SCHEMBL9340447 0.77 FDPS (0.46) CYP2D6MEN1LMNATP53KMT2A
SCHEMBL11702264 0.75 FDPS (0.49) CYP2D6MEN1LMNATP53KMT2A

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101765583-B Aldimines comprising hydroxyl groups, and compositions containing aldimine SIKA TECHNOLOGY AG 2014-06-04 CN claimed
US-8455100-B2 Aldimines comprising hydroxyl groups, and compositions containing aldimine SIKA TECHNOLOGY AG (CH) 2013-06-04 US claimed
US-8389772-B2 Aldehydes containing hydroxl groups SIKA TECHNOLOGY AG (CH) 2013-03-05 US claimed
US-20110195242-A1 ALDEHYDES CONTAINING HYDROXL GROUPS SIKA TECHNOLOGY AG (CH) 2011-08-11 US claimed
US-20100190014-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE SIKA TECHNOLOGY AG (CH) 2010-07-29 US claimed
EP-2200973-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE Sika Technology AG (CH) 2010-06-30 EP claimed
WO-2009027511-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE SIKA TECHNOLOGY AG (CH) 2009-03-05 WO claimed
EP-2030965-A1 Aldehydes containing hydroxyl groups Sika Technology AG (CH) 2009-03-04 EP claimed
EP-2030967-A1 Aldimines containing hydroxyl groups and compositions containing aldimine Sika Technology AG (CH) 2009-03-04 EP claimed
CN-101778814-B There is the aldehyde of hydroxyl SIKA技术股份公司 2016-08-03 CN disclosed
EP-2200970-B1 ALDEHYDES CONTAINING HYDROXYL GROUPS SIKA TECHNOLOGY AG (CH) 2016-01-06 EP disclosed
CN-101765583-B Aldimines comprising hydroxyl groups, and compositions containing aldimine SIKA TECHNOLOGY AG 2014-06-04 CN disclosed
US-8455100-B2 Aldimines comprising hydroxyl groups, and compositions containing aldimine SIKA TECHNOLOGY AG (CH) 2013-06-04 US disclosed
US-8389772-B2 Aldehydes containing hydroxl groups SIKA TECHNOLOGY AG (CH) 2013-03-05 US disclosed
EP-2200970-A1 ALDEHYDES CONTAINING HYDROXYL GROUPS Sika Technology AG (CH) 2010-06-30 EP disclosed
EP-2200973-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE Sika Technology AG (CH) 2010-06-30 EP disclosed
WO-2009027510-A1 ALDEHYDES CONTAINING HYDROXYL GROUPS SIKA TECHNOLOGY AG (CH) 2009-03-05 WO disclosed
WO-2009027511-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE SIKA TECHNOLOGY AG (CH) 2009-03-05 WO disclosed
EP-2030965-A1 Aldehydes containing hydroxyl groups Sika Technology AG (CH) 2009-03-04 EP disclosed
EP-2030967-A1 Aldimines containing hydroxyl groups and compositions containing aldimine Sika Technology AG (CH) 2009-03-04 EP 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 (2 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-20110195242-A1 ALDEHYDES CONTAINING HYDROXL GROUPS ALDH7A1, ALDH1A1, AOX1 CYP2D6 3243/4885MEN1 4047/4885LMNA 1740/4885
US-20100190014-A1 ALDIMINES COMPRISING HYDROXYL GROUPS, AND COMPOSITIONS CONTAINING ALDIMINE ADH5, ADH1A, ADH1C CYP2D6 382/4885MEN1 929/4885LMNA 1423/4885

“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.