SCHEMBL19253601

SCHEMBL19253601

Cc1cc(Br)ccc1C(=O)N1CCOC[C@H]1C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
KCNK3 O14649 2/20 0.42
CCKBR P32239 2/20 0.41
HCRTR1 O43613 3/20 0.39
HCRTR2 O43614 3/20 0.39
CYP3A4 P08684 3/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.39
PRMT5 O14744 3/20 0.39
JAK1 P23458 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
VNN1 O95497 1/20 0.38

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
SCHEMBL19253668 1.00 ALOX5AP (0.42) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL19253600 1.00 ALOX5AP (0.42) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL4693148 0.86 ALOX5AP (0.46) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL4505084 0.86 ALOX5AP (0.46) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL4692965 0.86 ALOX5AP (0.46) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL4505080 0.85 ALOX5AP (0.43) ALOX5APFEN1KCNK3CCKBRTP53
SCHEMBL4693145 0.85 ALOX5AP (0.43) ALOX5APFEN1KCNK3CCKBRTP53
SCHEMBL4692962 0.85 ALOX5AP (0.43) ALOX5APFEN1KCNK3CCKBRTP53
SCHEMBL21148691 0.85 POLB (0.41) ALOX5APFEN1KCNK3CCKBRHCRTR1
SCHEMBL21177332 0.81 KMT2A (0.47) ALOX5APFEN1GAAKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3209296-B1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2019-07-10 EP disclosed
EP-3209296-B1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2019-07-10 EP disclosed
US-10072025-B2 Ethyl N-boc piperidinyl pyrazolo pyridones as Janus kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2018-09-11 US disclosed
US-20170240567-A1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-08-24 US disclosed
US-20170240567-A1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-08-24 US disclosed
US-20170240567-A1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-08-24 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-20170240567-A1 ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS JAK1, JAK2, JAK3 ALOX5AP 656/4885FEN1 2768/4885KCNK3 1768/4885
US-10072025-B2 Ethyl N-boc piperidinyl pyrazolo pyridones as Janus kinase inhibitors JAK1, JAK2, JAK3 ALOX5AP 656/4885FEN1 2768/4885KCNK3 1768/4885

“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.