SCHEMBL4897978

SCHEMBL4897978

CC(C)(C)OC(=O)NCCn1cc(Br)ccc1=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.45
CAMK2D Q13557 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GFER P55789 1/20 0.41
FPR3 P25089 2/20 0.40
FPR2 P25090 2/20 0.40
MALT1 Q9UDY8 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
NPC1 O15118 1/20 0.39
RECQL P46063 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL25381100 0.92 CAMK2D (0.48) DRD2CAMK2DFPR3FPR2SIGMAR1
SCHEMBL21389397 0.85 ALDH1A1 (0.47) DRD2ALDH1A1GFERMALT1SIGMAR1
SCHEMBL22322288 0.81 DRD2 (0.41) DRD2CAMK2DALDH1A1GFERFPR3
SCHEMBL15765305 0.78 DRD2 (0.52) DRD2MALT1SIGMAR1NPC1RAB9A
SCHEMBL26208949 0.77 PRMT5 (0.49) DRD2CAMK2DALDH1A1GFER
SCHEMBL29237103 0.77 DRD2 (0.41) DRD2CAMK2DALDH1A1GFERFPR3
SCHEMBL4900416 0.77 DRD2 (0.41) DRD2
SCHEMBL23697929 0.76 KMT2A (0.44) ALDH1A1FPR2NPC1RECQLRAB9A
SCHEMBL7672969 0.75 MTNR1A (0.51) CAMK2DALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20808941 0.75 PSMB1 (0.44) DRD2CAMK2DALDH1A1NPC1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146512-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
WO-2023146512-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
US-8314087-B2 Nitrogen-containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2012-11-20 US disclosed
US-8314087-B2 Nitrogen-containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2012-11-20 US disclosed
US-8314087-B2 Nitrogen-containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2012-11-20 US disclosed
US-20080280917-A1 Nitrogen-Containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2008-11-13 US disclosed
US-20080280917-A1 Nitrogen-Containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2008-11-13 US disclosed
US-20080280917-A1 Nitrogen-Containing heterocyclyl ketones and methods of use AMGEN INC. (US) 2008-11-13 US disclosed
WO-2008103277-A2 NITROGEN-CONTAINING HETEROCYCLYL KETONES AND THEIR USE AS C-MET INHIBITORS AMGEN INC. (US) 2008-08-28 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 (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-20080280917-A1 Nitrogen-Containing heterocyclyl ketones and methods of use HGF, HGFAC, MET DRD2 4351/4885CAMK2D 4604/4885ALDH1A1 293/4885

“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.