SCHEMBL6285318

SCHEMBL6285318

CC(C)(C)OC(=O)NCc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.56
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
APEX1 P27695 1/20 0.51
GLS O94925 2/20 0.51
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
KDM4A O75164 1/20 0.48
TSHR P16473 1/20 0.48
BRD4 O60885 1/20 0.47

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
SCHEMBL7107994 0.88 KDM4E (0.54) CTSLKDM4EGAARXFP1APEX1
SCHEMBL31500361 0.88 KDM4E (0.54) CTSLKDM4EGAARXFP1APEX1
SCHEMBL25834083 0.86 KDM4E (0.63) CTSLKDM4EGAANPC1RAB9A
SCHEMBL7326336 0.86 CTSL (0.51) CTSLKDM4EGAARXFP1APEX1
SCHEMBL5102152 0.85 GLS (0.54) GAAGLSKDM4ATSHRBRD4
SCHEMBL626784 0.84 GAA (0.52) CTSLKDM4EGAAGLSKDM4A
SCHEMBL16181822 0.84 GLS (0.55) GLSKDM4ABRD4
SCHEMBL1165088 0.84 GLS (0.55) GAAGLSKDM4ABRD4
SCHEMBL8342682 0.84 GLS (0.55) GLSKDM4ABRD4
SCHEMBL13981921 0.84 GLS (0.55) GLSKDM4ABRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3307727-B1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER ASANA BIOSCIENCES LLC (US) 2023-10-04 EP disclosed
US-20230051842-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER ASANA BIOSCIENCES, LLC 2023-02-16 US disclosed
US-20220123235-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-04-21 US disclosed
EP-3842429-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER Asana BioSciences, LLC (US) 2021-06-30 EP disclosed
WO-2021086726-A1 IMPROVED METHODS, KITS, COMPOSITIONS AND DOSING REGIMENS FOR THE USE OF HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 Asan BioSciences, LLC (US) 2021-05-06 WO disclosed
US-20200179356-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER ASANA BIOSCIENCES, LLC 2020-06-11 US disclosed
US-6894050-B2 5-HT receptor ligands and uses thereof PFIZER INC. (US) 2005-05-17 US disclosed
US-20050090503-A1 5-HT receptor ligands and uses thereof PFIZER INC 2005-04-28 US disclosed
US-20050020604-A1 5-HT receptor ligands and uses thereof PFIZER INC 2005-01-27 US disclosed
EP-1401820-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF Pfizer Products Inc. (US) 2004-03-31 EP disclosed
US-20030125334-A1 5-HT receptor ligands and uses thereof CHIANG PHOEBE (US) 2003-07-03 US disclosed
WO-2003000666-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2003-01-03 WO 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 (6 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-20050090503-A1 5-HT receptor ligands and uses thereof HTR2A, HTR1A, HTR5A CTSL 3027/4885KDM4E 4327/4885GAA 2316/4885
US-20050020604-A1 5-HT receptor ligands and uses thereof HTR2A, HTR1A, HTR5A CTSL 3027/4885KDM4E 4327/4885GAA 2316/4885
US-20230051842-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER KRAS, NRAS, RAF1 CTSL 4308/4885KDM4E 969/4885GAA 3001/4885
US-20220123235-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES RER1, OXSR1, C1R CTSL 4122/4885KDM4E 3581/4885GAA 3332/4885
US-20030125334-A1 5-HT receptor ligands and uses thereof HTR1A, HTR2A, HTR5A CTSL 3215/4885KDM4E 4285/4885GAA 2360/4885
US-20200179356-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATMENT OF CANCER KRAS, NRAS, RAF1 CTSL 4308/4885KDM4E 969/4885GAA 3001/4885

“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.