SCHEMBL4015337

SCHEMBL4015337

N=C(N)NCc1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 2/20 0.59
ATG4B Q9Y4P1 2/20 0.59
IDO1 P14902 2/20 0.52
LMNA P02545 3/20 0.52
TP53 P04637 1/20 0.50
HTT P42858 1/20 0.49
HPGD P15428 3/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAOB P27338 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.45

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
SCHEMBL13158620 1.00 PLA2G1B (0.59) PLA2G1BATG4BIDO1LMNATP53
Hydrochloric Acid SCHEMBL27636314 0.98 PLA2G1B (0.57) PLA2G1BATG4BIDO1LMNATP53
Sulfuric Acid SCHEMBL11883310 0.91 CA1 (0.50) PLA2G1BATG4BIDO1LMNATP53
SCHEMBL3672272 0.89 CYP2C9 (0.48) PLA2G1BATG4BHPGDALDH1A1POLB
Trifluoroacetic Acid SCHEMBL5447693 0.87 HTT (0.50) PLA2G1BATG4BLMNATP53HTT
SCHEMBL17777347 0.85 PLA2G1B (0.52) PLA2G1BATG4BIDO1LMNATP53
Hydrochloric Acid SCHEMBL19371473 0.83 PLA2G1B (0.50) PLA2G1BATG4BIDO1LMNATP53
SCHEMBL14686209 0.81 TPSAB1 (0.59) TSHR
SCHEMBL6881703 0.81 CYP2C9 (0.42) PLA2G1BATG4BPOLBKMT2A
SCHEMBL6881708 0.81 EPHX2 (0.45) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350192-A Phenoxyalkyl guanidine derivative of targeting norepinephrine transporter as well as preparation method and application thereof 四川大学华西医院 2025-01-24 CN disclosed
US-11241509-B2 Ligands for imaging cardiac innervation LANTHEUS MEDICAL IMAGING, INC. (US) 2022-02-08 US disclosed
EP-2948188-B1 NEURONAL IMAGING AND TREATMENT TYLERTON INT HOLDINGS INC (VG) 2021-09-08 EP disclosed
EP-3567029-A1 COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS Lantheus Medical Imaging, Inc. (US) 2019-11-13 EP disclosed
EP-2753605-B1 COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS LANTHEUS MEDICAL IMAGING INC (US) 2019-03-27 EP disclosed
US-20150366523-A1 NEURONAL IMAGING AND TREATMENT TYLERTON INTERNATIONAL HOLDINGS INC. (VG) 2015-12-24 US disclosed
EP-1799684-B1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARM INC (US) 2014-12-03 EP disclosed
WO-2013036869-A2 COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS LANTHEUS MEDICAL IMAGING, INC. (US) 2013-03-14 WO disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
US-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-07-12 US disclosed
WO-2009087395-A1 WEIGHT REDUCING COMPOUNDS UNIVERSITY OF STRATHCLYDE (GB) 2009-07-16 WO disclosed
WO-2009087395-A1 WEIGHT REDUCING COMPOUNDS UNIVERSITY OF STRATHCLYDE (GB) 2009-07-16 WO disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-23 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-7459448-B2 Lactam compounds useful as protein kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
WO-2008083056-A2 LIGANDS FOR IMAGING CARDIAC INNERVATION LANTHEUS MEDICAL IMAGING, INC. (US) 2008-07-10 WO disclosed
EP-0944599-A1 TRIARYLETHANES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1999-09-29 EP disclosed
WO-1998028276-A1 TRIARYLETHANES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1998-07-02 WO disclosed
US-3714364-A PROCESS FOR LOWERING BLOOD SUGAR LEVELS PFIZER 1973-01-30 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 (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-20120178739-A1 LACTAM COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS PRKCI, PIK3CA, AKT1 PLA2G1B 1857/4885ATG4B 1544/4885IDO1 3282/4885
US-20090105213-A1 Lactam compounds useful as protein kinase inhibitors PRKCI, PIK3CA, AKT1 PLA2G1B 1857/4885ATG4B 1544/4885IDO1 3282/4885
US-11241509-B2 Ligands for imaging cardiac innervation TNNT2, PNMT, TNNC1 PLA2G1B 2678/4885ATG4B 4129/4885IDO1 2602/4885

“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.