SCHEMBL22018451

SCHEMBL22018451

CN1CCN(C(=O)OC2CCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 18/20 0.50
TPSD1 Q9BZJ3 18/20 0.50
TPSG1 Q9NRR2 18/20 0.50
PRSS1 P07477 4/20 0.48
F2 P00734 2/20 0.48
HTT P42858 1/20 0.44

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
SCHEMBL21428432 0.96 LMNA (0.47) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL21428419 0.94 LMNA (0.50) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL22018450 0.92 CYP1A2 (0.46) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL15219283 0.87 HTT (0.53) TPSAB1TPSD1TPSG1HTT
SCHEMBL21739558 0.84 HRH3 (0.45) TPSAB1TPSD1TPSG1HTT
SCHEMBL4283947 0.84 TPSAB1 (0.51) TPSAB1TPSD1TPSG1HTT
SCHEMBL8275268 0.84 TPSAB1 (0.51) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL28206534 0.82 HSD11B1 (0.52) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL12153397 0.81 TPSAB1 (0.49) TPSAB1TPSD1TPSG1PRSS1F2
SCHEMBL7421428 0.80 HPGD (0.54) TPSAB1TPSD1TPSG1PRSS1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778571-A1 (2E,4E)-5-PHENYL-PENTA-2,4-DIEN-1-ONE DERIVATIVE Bioway, Inc. (KR) 2021-02-17 EP disclosed
US-20200157048-A1 (2E,4E)-5-PHENYL-PENTA-2,4-DIEN-1-ONE DERIVATIVE BIOWAY., INC (KR) 2020-05-21 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-20200157048-A1 (2E,4E)-5-PHENYL-PENTA-2,4-DIEN-1-ONE DERIVATIVE PCK1, PCK2, ACACB TPSAB1 1732/4885TPSD1 1442/4885TPSG1 2102/4885

“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.