SCHEMBL7929384

SCHEMBL7929384

CCc1ccnc(-n2[nH]c3c(c2=O)CSC3)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 8/20 0.35
KDM5A P29375 5/20 0.35
KDM2B Q8NHM5 4/20 0.35
KDM5B Q9UGL1 6/20 0.35
KDM4E B2RXH2 1/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
PARP1 P09874 2/20 0.34
VHL P40337 3/20 0.33
SLC34A1 Q06495 2/20 0.33
KDM4A O75164 2/20 0.33
SLC11A2 P49281 2/20 0.32

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
SCHEMBL2571083 0.81 KDM4C (0.35) KDM4CKDM5AKDM2BKDM5BKDM4E
SCHEMBL15640481 0.67 NOS3 (0.35) KDM4CKDM5AKDM2BKDM5BNOS3
SCHEMBL12594227 0.65 NOS3 (0.45) NOS3NOS1NOS2PARP1
SCHEMBL12651287 0.65 POLB (0.44) KDM4ENOS3NOS1NOS2
SCHEMBL17263254 0.62 NOS3 (0.41) KDM4CKDM5AKDM2BKDM5BNOS3
SCHEMBL10274925 0.62 HRH4 (0.51) KDM4ENOS3NOS1NOS2
SCHEMBL11919149 0.62 ADRB1 (0.55) NOS3NOS1NOS2
SCHEMBL18888320 0.61 HRH4 (0.54) KDM4ENOS3NOS1NOS2
SCHEMBL13990855 0.61 HRH4 (0.54) KDM4ENOS3NOS1NOS2
SCHEMBL13390916 0.61 GAA (0.45) KDM4ENOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9359329-B2 Derivatives of 2-pyridin-2-yl-pyrazol-3(2H)-one, preparation and therapeutic use thereof SANOFI (FR) 2016-06-07 US disclosed
US-20160137627-A9 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2016-05-19 US disclosed
US-20140194470-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2014-07-10 US disclosed
US-20110301148-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-08 US disclosed
WO-2010076525-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-07-08 WO 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 (3 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-20160137627-A9 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF NR3C2, NR3C1, NR5A2 KDM4C 2974/4885KDM5A 2045/4885KDM2B 4059/4885
US-20140194470-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF NR3C2, NR3C1, NR5A2 KDM4C 2974/4885KDM5A 2045/4885KDM2B 4059/4885
US-20110301148-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF NR3C2, NR3C1, NR5A2 KDM4C 2974/4885KDM5A 2045/4885KDM2B 4059/4885

“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.