SCHEMBL19971984

SCHEMBL19971984

CC(CCCN)C(N)Cc1ccccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.44
CYP2D6 P10635 4/20 0.38
CYP3A4 P08684 3/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
HSPA5 P11021 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
HTR2A P28223 1/20 0.37
HRH1 P35367 1/20 0.37
IDO1 P14902 2/20 0.36
TSHR P16473 2/20 0.34
HIF1A Q16665 1/20 0.34
CA12 O43570 4/20 0.34
CA2 P00918 4/20 0.34
CA9 Q16790 4/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KCNH2 Q12809 2/20 0.33

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
SCHEMBL19971988 0.78 CYP2D6 (0.47) TAAR1CYP2D6CYP3A4SLC6A2SLC6A4
SCHEMBL20495643 0.77 CYP2D6 (0.53) TAAR1CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL4742791 0.74 SLC6A2 (0.50) TAAR1SLC6A2SLC6A4SLC6A3HSPA5
SCHEMBL5914402 0.74 SLC6A2 (0.50) TAAR1SLC6A2SLC6A4SLC6A3HSPA5
SCHEMBL266416 0.74 SLC6A2 (0.50) TAAR1SLC6A2SLC6A4SLC6A3HSPA5
SCHEMBL29291442 0.73 TAAR1 (0.53) TAAR1CYP2D6CYP3A4SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL724080 0.72 SLC6A2 (0.49) TAAR1SLC6A2SLC6A4SLC6A3POLB
Bromide SCHEMBL6052803 0.72 SLC6A2 (0.49) TAAR1SLC6A2SLC6A4SLC6A3HSPA5
Iodide SCHEMBL6052802 0.72 SLC6A2 (0.49) TAAR1SLC6A2SLC6A4SLC6A3HSPA5
SCHEMBL12658152 0.71 TAAR1 (0.50) TAAR1CYP2D6CYP3A4SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3274328-B1 AMINE FOR FAST SETTING EPOXY RESIN COMPOSITIONS SIKA TECH AG (CH) 2019-08-28 EP disclosed
US-10221344-B2 Amine for rapid-curing epoxy resin compositions SIKA TECHNOLOGY AG (CH) 2019-03-05 US disclosed
US-20180079710-A1 AMINE FOR RAPID-CURING EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2018-03-22 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 (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-10221344-B2 Amine for rapid-curing epoxy resin compositions EEF1A1, KDM5B, EEF1A2 TAAR1 178/4885CYP2D6 1587/4885CYP3A4 1032/4885
US-20180079710-A1 AMINE FOR RAPID-CURING EPOXY RESIN COMPOSITIONS EEF1A1, KDM5B, SEM1 TAAR1 174/4885CYP2D6 1542/4885CYP3A4 1009/4885

“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.