SCHEMBL2507229

SCHEMBL2507229

O=C1CC[C@@H](C(=O)O)[C@H](c2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MCL1 Q07820 3/20 0.47
HTT P42858 1/20 0.44
BCL2L1 Q07817 2/20 0.44
LMNA P02545 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C1 Q04828 1/20 0.42
POLB P06746 1/20 0.42
FFAR1 O14842 1/20 0.41
HDAC4 P56524 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
SLC9A1 P19634 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL2507227 1.00 MEN1 (0.48) MEN1KMT2AMCL1HTTBCL2L1
SCHEMBL1695729 1.00 MEN1 (0.48) MEN1KMT2AMCL1HTTBCL2L1
SCHEMBL1695474 0.85 CYP2C9 (0.41) MEN1KMT2AMCL1LMNAFFAR1
SCHEMBL3115351 0.85 GAA (0.40) MCL1HTTPOLBGAASLC9A1
SCHEMBL3115335 0.85 GAA (0.40) MCL1HTTPOLBGAASLC9A1
SCHEMBL1695410 0.85 TDP1 (0.43) MEN1KMT2AMCL1HTTFFAR1
SCHEMBL3115343 0.85 GAA (0.40) MCL1HTTPOLBGAASLC9A1
SCHEMBL15194685 0.85 CYP2C9 (0.41) MEN1KMT2AMCL1LMNAFFAR1
SCHEMBL7226907 0.84 MCL1 (0.50) MCL1BCL2L1LMNAAKR1C3AKR1C1
SCHEMBL7226904 0.84 MCL1 (0.50) MCL1BCL2L1LMNAAKR1C3AKR1C1

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
US-20210221785-A1 AMINO-PYRIMIDONYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM VERNALIS (R&D) LTD (GB) 2021-07-22 US disclosed
EP-3818054-A1 AMINO-PYRIMIDONYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Les Laboratoires Servier (FR) 2021-05-12 EP disclosed
CN-112368276-A Amino-pyrimidinone derivatives, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2021-02-12 CN disclosed
WO-2020008013-A1 AMINO-PYRIMIDONYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2020-01-09 WO disclosed
US-20140243290-A1 Aminopyrimidines as SYK Inhibitors ALTMAN MICHAEL D (US) 2014-08-28 US disclosed
US-8759366-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2014-06-24 US disclosed
US-8669252-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP. (US) 2014-03-11 US disclosed
US-8551984-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2013-10-08 US disclosed
US-20130217660-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME LLC 2013-08-22 US disclosed
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2012-11-01 US disclosed
EP-2513098-A1 AMINOPYRIMIDINES AS SYK INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-24 EP disclosed
US-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2011-10-06 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 (5 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-20110245205-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK MEN1 4876/4885KMT2A 1532/4885MCL1 3661/4885
US-20210221785-A1 AMINO-PYRIMIDONYL DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DHFR, QDPR, DPYD MEN1 1778/4885KMT2A 3247/4885MCL1 3381/4885
US-20140243290-A1 Aminopyrimidines as SYK Inhibitors SYK, BTK, LCK MEN1 4876/4885KMT2A 1532/4885MCL1 3661/4885
US-20130217660-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS PRCP, PREP, ENPEP MEN1 3238/4885KMT2A 2172/4885MCL1 4390/4885
US-20120277192-A1 AMINOPYRIMIDINES AS SYK INHIBITORS SYK, BTK, LCK MEN1 4876/4885KMT2A 1532/4885MCL1 3661/4885

“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.