SCHEMBL18338142

SCHEMBL18338142

CCN(C(=O)Cn1c(C(=O)OC)cc2ccc(OC)cc21)c1cccc(C)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.58
MTNR1A P48039 2/20 0.51
MTNR1B P49286 2/20 0.51
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HSD17B10 Q99714 2/20 0.49
LMNA P02545 2/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 3/20 0.48
RECQL P46063 1/20 0.47
RXFP1 Q9HBX9 1/20 0.44
POLQ O75417 1/20 0.42

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
SCHEMBL18338261 0.91 MEN1 (0.50) TP53ALDH1A1HPGDNPSR1KDM4E
SCHEMBL21975561 0.88 MEN1 (0.53) TP53ALDH1A1HPGDNPSR1KDM4E
SCHEMBL18338188 0.88 TP53 (0.65) TP53MTNR1AMTNR1BALDH1A1NPSR1
SCHEMBL18350042 0.88 TP53 (0.57) TP53ALDH1A1NPSR1KDM4ELMNA
SCHEMBL18338221 0.83 TP53 (0.42) TP53MTNR1AMTNR1BALDH1A1HPGD
SCHEMBL18338219 0.83 TP53 (0.42) TP53MTNR1AMTNR1BALDH1A1HPGD
SCHEMBL21900204 0.83 TP53 (0.42) TP53MTNR1AMTNR1BALDH1A1HPGD
SCHEMBL18345112 0.80 CCR2 (0.49) MTNR1AMTNR1BALDH1A1HPGDKDM4E
SCHEMBL18338268 0.80 TP53 (0.67) TP53NPSR1MEN1KMT2AMAPT
SCHEMBL18338295 0.80 LMNA (0.66) TP53ALDH1A1KDM4EHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3313846-B1 THIENOPYRROLE COMPOUNDS AND USES THEREOF AS INHIBITORS OF OPLOPHORUS-DERIVED LUCIFERASES PROMEGA CORP (US) 2020-05-06 EP disclosed
EP-3313846-B1 THIENOPYRROLE COMPOUNDS AND USES THEREOF AS INHIBITORS OF OPLOPHORUS-DERIVED LUCIFERASES PROMEGA CORP (US) 2020-05-06 EP disclosed
US-20200063110-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF PROMEGA CORPORATION 2020-02-27 US disclosed
US-20200063110-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF PROMEGA CORPORATION 2020-02-27 US disclosed
EP-3313846-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF AS INHIBITORS OF OPLOPHORUS-DERIVED LUCIFERASES Promega Corporation (US) 2018-05-02 EP disclosed
WO-2016210294-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF AS INHIBITORS OF OPLOPHORUS-DERIVED LUCIFERASES PROMEGA CORPORATION (US) 2016-12-29 WO disclosed
US-20160376568-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2016-12-29 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-20160376568-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF THOP1, TYMP, CREBBP TP53 3720/4885MTNR1A 890/4885MTNR1B 771/4885
US-20200063110-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF THOP1, TYMP, CREBBP TP53 3720/4885MTNR1A 890/4885MTNR1B 771/4885

“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.