SCHEMBL20577772

SCHEMBL20577772

Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1F

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.80
GAA P10253 1/20 0.64
ALDH1A1 P00352 1/20 0.61
RXFP1 Q9HBX9 2/20 0.58
P2RX1 P51575 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.56
KCNK3 O14649 2/20 0.56
MEN1 O00255 2/20 0.55
RAB9A P51151 2/20 0.55
KMT2A Q03164 2/20 0.55
NPC1 O15118 1/20 0.55
HDAC3 O15379 1/20 0.55
HDAC1 Q13547 1/20 0.55
TLR7 Q9NYK1 1/20 0.54
HTT P42858 1/20 0.53
KCNK9 Q9NPC2 1/20 0.52
CSF1R P07333 1/20 0.52
KIT P10721 1/20 0.52

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
SCHEMBL19233515 0.84 PTGS1 (0.68) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL20577950 0.83 PTGS1 (0.56) PTGS1GAA
SCHEMBL20578052 0.83 PTGS1 (0.74) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL20577803 0.82 PTGS1 (0.64) PTGS1GAAALDH1A1P2RX1LMNA
SCHEMBL20577770 0.80 PTGS1 (0.70) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL30136206 0.79 PTGS1 (0.72) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL28633823 0.79 PTGS1 (0.72) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL11868617 0.79 PTGS1 (0.72) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL20578104 0.79 RXFP1 (0.60) PTGS1GAAALDH1A1RXFP1P2RX1
SCHEMBL4766874 0.78 RXFP1 (0.73) PTGS1GAAALDH1A1RXFP1P2RX1

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 1195/4885GAA 4851/4885ALDH1A1 2063/4885
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 1195/4885GAA 4851/4885ALDH1A1 2063/4885

“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.