SCHEMBL16620303

SCHEMBL16620303

CC(C)(C)OC(=O)N1CCC[C@@H](N2Cc3cc4c(Br)nn(C(c5ccccc5)(c5ccccc5)c5ccccc5)c4cc3NC2=O)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.40
MAPK1 P28482 10/20 0.38
RAMP1 O60894 3/20 0.37
CALCRL Q16602 3/20 0.37
USP30 Q70CQ3 3/20 0.37
BTK Q06187 1/20 0.36
HPGDS O60760 1/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36

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
SCHEMBL16620301 1.00 FPR2 (0.40) FPR2MAPK1RAMP1CALCRLUSP30
SCHEMBL16619943 0.85 MAPK1 (0.52) MAPK1BTKHPGDS
SCHEMBL16619942 0.85 MAPK1 (0.52) MAPK1BTKHPGDS
SCHEMBL12073270 0.74 USP30 (0.60) USP30
SCHEMBL9987374 0.74 USP30 (0.60) USP30
SCHEMBL1198743 0.73 HPGDS (0.43) USP30BTKHPGDSPRMT5
SCHEMBL16620012 0.73 USP30 (0.44) FPR2USP30
SCHEMBL16620008 0.73 USP30 (0.44) FPR2USP30
SCHEMBL15239595 0.73 HPGDS (0.46) USP30BTKHPGDSPRMT5
SCHEMBL15239593 0.73 HPGDS (0.46) USP30BTKHPGDSPRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292194-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2019-09-26 US disclosed
US-10301317-B2 Inhibitors of ERK and methods of use KURA ONCOLOGY, INC. (US) 2019-05-28 US disclosed
EP-3363800-A1 HETEROCYCLIC INHIBITORS OF ERK AND METHODS OF USE Kura Oncology, Inc. (US) 2018-08-22 EP disclosed
US-9951078-B2 Inhibitors of ERK and methods of use KURA ONCOLOGY, INC. (US) 2018-04-24 US disclosed
EP-3052096-B1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY INC (US) 2018-01-17 EP disclosed
US-20170226110-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2017-08-10 US disclosed
US-9624228-B2 Inhibitors of ERK and methods of use KURA ONCOLOGY, INC. (US) 2017-04-18 US disclosed
US-20160237091-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2016-08-18 US disclosed
EP-3052096-A1 INHIBITORS OF ERK AND METHODS OF USE Kura Oncology, Inc. (US) 2016-08-10 EP disclosed
WO-2015051341-A1 INHIBITORS OF ERK AND METHODS OF USE ARAXES PHARMA LLC (US) 2015-04-09 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 (4 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-10301317-B2 Inhibitors of ERK and methods of use MAP3K1, MAP3K2, MAP3K6 FPR2 2577/4885MAPK1 12/4885RAMP1 2781/4885
US-20170226110-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 FPR2 2577/4885MAPK1 12/4885RAMP1 2781/4885
US-20190292194-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 FPR2 2577/4885MAPK1 12/4885RAMP1 2781/4885
US-20160237091-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 FPR2 2577/4885MAPK1 12/4885RAMP1 2781/4885

“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.