SCHEMBL20577803

SCHEMBL20577803

Nc1ccc(F)c(NC(=O)c2cccc(C(F)(F)F)c2)c1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.64
P2RX1 P51575 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 3/20 0.53
KCNK3 O14649 2/20 0.53
KMT2A Q03164 2/20 0.51
GAA P10253 1/20 0.51
MEN1 O00255 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
KCNK9 Q9NPC2 1/20 0.50
CLK1 P49759 1/20 0.49
KCNJ11 Q14654 1/20 0.49
TLR7 Q9NYK1 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KCNQ3 O43525 1/20 0.49
KCNQ2 O43526 1/20 0.49
KCNE1 P15382 1/20 0.49
KCNQ1 P51787 1/20 0.49
KCNQ5 Q9NR82 1/20 0.49

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
SCHEMBL20577750 0.83 KDR (0.50) PTGS1
SCHEMBL28930243 0.82 LMNA (0.56) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL20577772 0.82 PTGS1 (0.80) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL22120885 0.81 HDAC1 (0.56) PTGS1LMNAKMT2AMEN1RAB9A
SCHEMBL17103625 0.81 PTGS1 (0.71) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL19233515 0.80 PTGS1 (0.68) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL20577770 0.78 PTGS1 (0.70) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL20578052 0.78 PTGS1 (0.74) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL20577767 0.77 RXFP1 (0.53) PTGS1P2RX1LMNAMAPTKCNK3
SCHEMBL17103527 0.75 MAPT (0.70) PTGS1P2RX1LMNAMAPTKCNK3

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
EP-3412670-B1 PYRIDINE DERIVATIVES INHIBITING RAF KINASE AND VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, PHARMACEUTICAL COMPOSITION CONTAINING THEM AND USE THEREOF SAMJIN PHARM CO LTD (KR) 2022-03-09 EP disclosed
CN-109071543-B Pyridine derivatives inhibiting RAF kinase and vascular endothelial growth factor receptor, process for their preparation, pharmaceutical compositions containing them and their use 三进制药株式会社 2021-07-16 CN disclosed
US-10844062-B2 Pyridine derivative inhibiting RAF kinase and vascular endothelial growth factor receptor, method for preparing same, pharmaceutical composition containing same, and use thereof INCHEON UNIVERSITY INDUSTRY ACADEMIC COOPERATION FOUNDATION (KR) 2020-11-24 US disclosed
US-20190300531-A1 Pyridine Derivative Inhibiting RAF Kinase and Vascular Endothelial Growth Factor Receptor, Method for Preparing Same, Pharmaceutical Composition Containing Same, and Use Thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2019-10-03 US disclosed
EP-3412670-A1 PYRIDINE DERIVATIVE INHIBITING RAF KINASE AND VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, METHOD FOR PREPARING SAME, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2018-12-12 EP 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-20190300531-A1 Pyridine Derivative Inhibiting RAF Kinase and Vascular Endothelial Growth Factor Receptor, Method for Preparing Same, Pharmaceutical Composition Containing Same, and Use Thereof BRAF, KDR, RAF1 PTGS1 1195/4885P2RX1 852/4885LMNA 4836/4885
US-10844062-B2 Pyridine derivative inhibiting RAF kinase and vascular endothelial growth factor receptor, method for preparing same, pharmaceutical composition containing same, and use thereof BRAF, KDR, RAF1 PTGS1 1195/4885P2RX1 852/4885LMNA 4836/4885

“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.