SCHEMBL5066870

SCHEMBL5066870

N#Cc1cccc(-n2nc(C(F)(F)F)cc2-c2ccco2)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 3/20 0.44
MAPT P10636 1/20 0.44
PTGS1 P23219 1/20 0.44
TSHR P16473 2/20 0.43
KLKB1 P03952 2/20 0.38
NR3C2 P08235 1/20 0.38

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
SCHEMBL30414623 1.00 PDPK1 (0.44) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL24467972 0.88 PDPK1 (0.56) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL950143 0.82 PTGS1 (0.64) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL14062925 0.82 ALDH1A1 (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL18622987 0.82 ALDH1A1 (0.67) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL5067585 0.82 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL5387205 0.82 FLT3 (0.44) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5069580 0.81 KDM4E (0.42) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5069634 0.79 KLKB1 (0.57) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL14063016 0.79 KDM4E (0.44) PDPK1KDM4EALDH1A1HPGDHSD17B10

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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4663636-A2 TRIFLUOROMETHYL SUBSTITUTED PYRAZOLES AS HUMAN PLASMA KALLIKREIN INHIBITORS BioCryst Pharmaceuticals, Inc. (US) 2025-12-17 EP disclosed
US-20250270171-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2025-08-28 US disclosed
US-20250257040-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2025-08-14 US disclosed
EP-4180424-B1 SUBSTITUTED PYRAZOLES AS HUMAN PLASMA KALLIKREIN INHIBITORS BIOCRYST PHARM INC (US) 2025-06-25 EP disclosed
US-12162838-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2024-12-10 US disclosed
US-12116346-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2024-10-15 US disclosed
CN-113307772-B Human plasma kallikrein inhibitors 拜奥克里斯特制药公司 2024-06-28 CN disclosed
US-20240150295-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-05-09 US disclosed
US-20240150296-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-05-09 US disclosed
US-11708333-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-07-25 US disclosed
US-20170073314-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2017-03-16 US disclosed
US-20170073314-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2017-03-16 US disclosed
US-20130023563-A1 AMIDINOANILINE DERIVATIVE AJINOMOTO CO., INC. (JP) 2013-01-24 US disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-8338437-B2 Methyl transferase inhibitors; antiproliferative agents; antiinflammatory agents; immunotherapy; infection therapy METHYLGENE INC. (CA) 2012-12-25 US disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
US-20080280925-A1 Amines as Small Molecule Inhibitors METHYLGENE INC. 2008-11-13 US disclosed
WO-2008104077-A1 SMALL MOLECULE INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASES (PRMTS) METHYLGENE INC. (CA) 2008-09-04 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 (10 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-20080280925-A1 Amines as Small Molecule Inhibitors CARM1, PRMT1, PRMT3 PDPK1 2538/4885KDM4E 369/4885ALDH1A1 2119/4885
US-20130023563-A1 AMIDINOANILINE DERIVATIVE F11, SERPINC1, F8 PDPK1 863/4885KDM4E 3425/4885ALDH1A1 2492/4885
US-12116346-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885
US-20250270171-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885
US-20240150296-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885
US-20170073314-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK1, KLK5 PDPK1 1051/4885KDM4E 1757/4885ALDH1A1 1065/4885
US-20240150295-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885
US-20250257040-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885
US-11708333-B2 Human plasma kallikrein inhibitors KLKB1, KLK1, KLK5 PDPK1 1034/4885KDM4E 1688/4885ALDH1A1 1425/4885
US-12162838-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 PDPK1 1525/4885KDM4E 954/4885ALDH1A1 1136/4885

“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.