SCHEMBL19898263

SCHEMBL19898263

CC(O)C(=O)NC[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CO1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTK Q06187 6/20 0.42
KMT2A Q03164 3/20 0.40
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
EPHX1 P07099 1/20 0.37
CTSK P43235 2/20 0.36
MEN1 O00255 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL19898261 1.00 BTK (0.42) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL19898893 1.00 BTK (0.42) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL19898977 0.85 BTK (0.45) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL12528145 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL4778890 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL30772643 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL603316 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL12527395 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL603315 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1
SCHEMBL19898629 0.79 BTK (0.46) BTKKMT2AKDM1AMAOBEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11020398-B2 Amino-pyrrolopyrimidinone compounds and methods of use thereof ARQULE, INC. (US) 2021-06-01 US disclosed
EP-3504213-A1 AMINO-PYRROLOPYRIMIDINONE COMPOUNDS AND METHODS OF USE THEREOF ArQule, Inc. (US) 2019-07-03 EP disclosed
WO-2018039310-A1 AMINO-PYRROLOPYRIMIDINONE COMPOUNDS AND METHODS OF USE THEREOF ARQULE, INC. (US) 2018-03-01 WO disclosed
US-20180055846-A1 AMINO-PYRROLOPYRIMIDINONE COMPOUNDS AND METHODS OF USE THEREOF ARQULE, INC. 2018-03-01 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-11020398-B2 Amino-pyrrolopyrimidinone compounds and methods of use thereof BTK, SYK, LCK BTK 1/4885KMT2A 2325/4885KDM1A 1485/4885
US-20180055846-A1 AMINO-PYRROLOPYRIMIDINONE COMPOUNDS AND METHODS OF USE THEREOF BTK, SYK, LCK BTK 1/4885KMT2A 2325/4885KDM1A 1485/4885

“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.