SCHEMBL19253755

SCHEMBL19253755

Cc1cc(Br)ccc1C1CN(C=O)CCO1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.37
CTSK P43235 1/20 0.37
PDE2A O00408 2/20 0.34
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL3120308 0.78 CTSL (0.43) CTSLCTSK
SCHEMBL3120324 0.77 NPC1 (0.36) CTSLCTSKALDH1A1
SCHEMBL2540747 0.77 CYP1A2 (0.35)
SCHEMBL19253740 0.74 CTSL (0.37) CTSLCTSKHTT
SCHEMBL27659663 0.73 GABRA1 (0.33) PDE2AHTTALDH1A1
SCHEMBL19253667 0.73 HPGD (0.35) CTSLCTSKHPGDHTTPOLB
SCHEMBL19253599 0.73 HPGD (0.35) CTSLCTSKHPGDHTTPOLB
SCHEMBL14994640 0.73 PDE4B (0.35)
SCHEMBL4481632 0.72 CNR1 (0.36)
SCHEMBL30623726 0.71 MAPT (0.40) HPGDHTTPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 CTSL 1574/4885CTSK 668/4885PDE2A 466/4885
US-10072025-B2 Ethyl N-boc piperidinyl pyrazolo pyridones as Janus kinase inhibitors JAK1, JAK2, JAK3 CTSL 1574/4885CTSK 668/4885PDE2A 466/4885

“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.