SCHEMBL3382142

SCHEMBL3382142

CC(=O)Oc1ccc(Br)cc1C(=O)Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.54
PTGDR2 Q9Y5Y4 2/20 0.47
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.44
HSD17B10 Q99714 4/20 0.44
TSHR P16473 3/20 0.44
PTGS1 P23219 2/20 0.44
PTGS2 P35354 2/20 0.44
HPGD P15428 2/20 0.44
ESR1 P03372 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
HMGB1 P09429 1/20 0.44
GGT1 P19440 1/20 0.44
BLM P54132 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
MAOA P21397 1/20 0.41

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
SCHEMBL25027 0.85 CFD (0.73) CFDPTGDR2ALDH1A1KDM4EHSD17B10
SCHEMBL789388 0.85 PTGDR2 (0.63) CFDPTGDR2ALDH1A1KDM4EHSD17B10
SCHEMBL477809 0.84 MAPT (0.55) PTGDR2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30362156 0.84 MAPT (0.55) PTGDR2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL11330589 0.82 KDM4E (0.57) CFDALDH1A1KDM4EHSD17B10TSHR
SCHEMBL239981 0.82 CFD (0.50) CFDALDH1A1KDM4EHSD17B10TSHR
SCHEMBL3453790 0.81 TSHR (0.58) CFDPTGDR2ALDH1A1KDM4EHSD17B10
SCHEMBL1603859 0.81 HSD17B10 (0.58) CFDPTGDR2ALDH1A1KDM4EHSD17B10
SCHEMBL1162227 0.81 CFD (0.49) CFDALDH1A1KDM4EHSD17B10TSHR
SCHEMBL1021383 0.80 CFD (0.51) CFDALDH1A1KDM4ETSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11911353-B2 Fatty acid synthase inhibitor and application thereof JIANGNAN UNIVERSITY (CN) 2024-02-27 US disclosed
US-11911353-B2 Fatty acid synthase inhibitor and application thereof JIANGNAN UNIVERSITY (CN) 2024-02-27 US disclosed
EP-1615897-B1 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMA INC (US) 2010-11-24 EP disclosed
US-7491728-B2 Pyrimidinone compounds as calcilytics SMITHKLINE BEECHAM CORP. (US) 2009-02-17 US disclosed
EP-1615897-A4 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMA INC (US) 2008-07-23 EP disclosed
US-20070197555-A1 Pyrimidinone Compounds As Calcilytics GLAXOSMITHKLINE LLC 2007-08-23 US disclosed
CN-1835928-A Pyrimidone compounds as calcium-sensitive receptor antagonists NPS PHARMA INC (US) 2006-09-20 CN disclosed
EP-1615897-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2006-01-18 EP disclosed
WO-2004092120-A2 PYRIMIDINONE COMPOUNDS AS CALCILYTICS NPS PHARMACEUTICALS, INC. (US) 2004-10-28 WO disclosed
WO-1998027080-A1 CHROMONES USEFUL AS FUNGICIDES AGREVO UK LIMITED (GB) 1998-06-25 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 (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-11911353-B2 Fatty acid synthase inhibitor and application thereof FASN, SCD, FADS2 CFD 4819/4885PTGDR2 2694/4885ALDH1A1 1287/4885
US-20070197555-A1 Pyrimidinone Compounds As Calcilytics TYMP, DPYD, UMPS CFD 1492/4885PTGDR2 639/4885ALDH1A1 2151/4885

“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.