SCHEMBL14320271

SCHEMBL14320271

CS(=O)(=O)CC(=O)N1CCC(c2ccc(N)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 4/20 0.46
TLR8 Q9NR97 4/20 0.46
TLR7 Q9NYK1 4/20 0.46
SLC18A3 Q16572 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
NAMPT P43490 2/20 0.41
QDPR P09417 2/20 0.40
HCRTR2 O43614 1/20 0.40
CSF1R P07333 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL21526404 0.82 SLC18A3 (0.48) TLR9TLR8TLR7SLC18A3KDM1A
SCHEMBL3527556 0.81 TLR7 (0.47) TLR9TLR8TLR7SLC18A3NAMPT
SCHEMBL31489002 0.79 NAMPT (0.61) TLR9TLR8TLR7SLC18A3KDM1A
SCHEMBL3080099 0.79 QDPR (0.62) SLC18A3KDM1AMAOBQDPRALDH1A1
SCHEMBL16255594 0.78 KDM1A (0.45) SLC18A3KDM1AMAOBNAMPTQDPR
SCHEMBL14320559 0.78 KDM1A (0.45) TLR9TLR8TLR7SLC18A3KDM1A
SCHEMBL3543343 0.77 NPC1 (0.44) TLR9TLR8TLR7NPC1RAB9A
SCHEMBL3525695 0.77 TLR9 (0.48) TLR9TLR8TLR7SLC18A3KDM1A
SCHEMBL265000 0.77 SLC18A3 (0.51) SLC18A3NPC1RAB9ACA12CA1
SCHEMBL14321122 0.75 SLC18A3 (0.46) SLC18A3NPC1RAB9AKDM1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 US disclosed
US-9802937-B2 Substituted pyrazolo{4,3-D}pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-10-31 US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 US disclosed
US-9499535-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2016-11-22 US disclosed
EP-2699572-B1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2016-08-10 EP disclosed
EP-2699579-B1 PYRAZOLO[4,3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-10-07 EP disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 US disclosed
US-20150259340-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-17 US disclosed
WO-2014060112-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 WO disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 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 (7 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-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK TLR9 516/4885TLR8 1637/4885TLR7 936/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK TLR9 546/4885TLR8 1588/4885TLR7 935/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK TLR9 516/4885TLR8 1637/4885TLR7 936/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK TLR9 516/4885TLR8 1637/4885TLR7 936/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 TLR9 821/4885TLR8 2418/4885TLR7 1397/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK TLR9 512/4885TLR8 1490/4885TLR7 914/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK TLR9 512/4885TLR8 1490/4885TLR7 914/4885

“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.