SCHEMBL19971989

SCHEMBL19971989

NCC(N)CCc1ccccc1O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.59
HSPA5 P11021 1/20 0.45
SLC6A4 P31645 3/20 0.44
CYP2D6 P10635 2/20 0.44
CYP3A4 P08684 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
MPO P05164 5/20 0.43
IDO1 P14902 2/20 0.42
TSHR P16473 1/20 0.41
HIF1A Q16665 1/20 0.41
HTR1A P08908 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
AKR1B1 P15121 1/20 0.39
CA12 O43570 1/20 0.38
CA2 P00918 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
SCHEMBL623900 0.81 TAAR1 (0.50) TAAR1HSPA5SLC6A4CYP2D6SLC6A2
SCHEMBL2549011 0.80 TAAR1 (0.52) TAAR1HSPA5SLC6A4CYP2D6CYP3A4
SCHEMBL30520716 0.78 SLC6A4 (0.61) TAAR1HSPA5SLC6A4CYP2D6SLC6A2
SCHEMBL265239 0.78 SLC6A4 (0.61) TAAR1HSPA5SLC6A4CYP2D6SLC6A2
SCHEMBL13976392 0.77 TAAR1 (0.58) TAAR1HSPA5SLC6A4CYP2D6MPO
SCHEMBL3571928 0.75 TAAR1 (0.56) TAAR1HSPA5SLC6A4CYP2D6MPO
SCHEMBL3442080 0.75 HTR2A (0.52) TAAR1CYP2D6
SCHEMBL1427697 0.74 TAAR1 (1.00) TAAR1HSPA5SLC6A4CYP2D6MPO
SCHEMBL29769908 0.74 TAAR1 (1.00) TAAR1HSPA5SLC6A4CYP2D6MPO
SCHEMBL31370243 0.74 TAAR1 (0.50) TAAR1CYP3A4HIF1AAKR1B1

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
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
CN-107428911-A Amine for fast-curing epoxy resin composition SIKA技术股份公司 2017-12-01 CN 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 178/4885HSPA5 2551/4885SLC6A4 1752/4885
US-20180079710-A1 AMINE FOR RAPID-CURING EPOXY RESIN COMPOSITIONS EEF1A1, KDM5B, SEM1 TAAR1 174/4885HSPA5 2518/4885SLC6A4 1801/4885

“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.