SCHEMBL30918323

SCHEMBL30918323

COC(=O)CNC1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.42
SLC6A3 Q01959 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
PDE8B O95263 1/20 0.34
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
TET2 Q6N021 1/20 0.32

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
SCHEMBL901643 0.80 ALDH1A1 (0.33) SLC6A3MEN1KMT2AALDH1A1HPGD
SCHEMBL343088 0.80 ALDH1A1 (0.33) SLC6A3MEN1KMT2AALDH1A1HPGD
Water SCHEMBL27791399 0.79 EPHX2 (0.41) EPHX2ALDH1A1HSD17B10LMNAPOLB
SCHEMBL7335663 0.74 ALDH1A1 (0.38) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL7347720 0.74 ALDH1A1 (0.38) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL1977433 0.74 EPHX2 (0.59) EPHX2MEN1KMT2APOLB
SCHEMBL6687035 0.73
Hydrochloric Acid SCHEMBL6871695 0.72 EPHX2 (0.58) EPHX2MEN1KMT2AALDH1A1HPGD
SCHEMBL2411177 0.72 EPHX2 (0.62) EPHX2MEN1KMT2AALDH1A1HPGD
SCHEMBL18845118 0.72 EPHX2 (0.62) EPHX2MEN1KMT2AALDH1A1HPGD

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-4622991-A2 SYNTHESIS OF A CYCLIC PEPTIDE Janssen Pharmaceutica NV (BE) 2025-10-01 EP disclosed
US-20240218014-A1 SYNTHESIS OF A CYCLIC PEPTIDE JANSSEN PHARMACEUTICA NV (BE) 2024-07-04 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-20240218014-A1 SYNTHESIS OF A CYCLIC PEPTIDE VIP, QPCT, PTMS EPHX2 3190/4885SLC6A3 4646/4885MEN1 361/4885

“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.