SCHEMBL1786065

SCHEMBL1786065

O=C(O)[C@@H](O)c1cccc(Br)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
MAPK1 P28482 1/20 0.59
ALDH1A1 P00352 1/20 0.45
GLS O94925 1/20 0.45
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
PARP1 P09874 1/20 0.42
BLM P54132 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TSHR P16473 1/20 0.42
CTSA P10619 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP2D6 P10635 1/20 0.40
SRC P12931 1/20 0.40

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
SCHEMBL31736245 1.00 LMNA (0.59) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL742997 1.00 LMNA (0.59) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL31038341 1.00 LMNA (0.59) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL742998 1.00 LMNA (0.59) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL276569 0.85 LMNA (0.73) LMNAMAPK1BLMNPSR1TSHR
SCHEMBL20930558 0.83 CYP2D6 (0.60) LMNAMAPK1ALDH1A1IDO1TDO2
SCHEMBL4530990 0.82 ALDH1A1 (0.44) MAPK1ALDH1A1GLSIDO1TDO2
SCHEMBL11217020 0.82 GLS (0.44) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL23174036 0.82 CES2 (0.67) LMNAMAPK1ALDH1A1GLSIDO1
SCHEMBL5856096 0.82 SRC (0.58) LMNAMAPK1ALDH1A1IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110124909-A1 NOVEL PROCESS GENERICS [UK] LIMITED (GB) 2011-05-26 US claimed
EP-2262761-A1 NOVEL PROCESS Generics [UK] Limited (GB) 2010-12-22 EP claimed
WO-2009122215-A1 NOVEL PROCESS GENERICS [UK] LIMITED (GB) 2009-10-08 WO claimed
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
WO-2021221169-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2021-11-04 WO disclosed
US-10857517-B2 Porous chiral materials and uses thereof NANKAI UNIVERSITY (CN) 2020-12-08 US disclosed
US-9315792-B2 Nitrilases, nucleic acids encoding them and methods for making and using them BASF ENZYMES LLC (US) 2016-04-19 US disclosed
US-9217164-B2 Nitrilases, nucleic acids encoding them and methods for making and using them BASF ENZYMES LLC (US) 2015-12-22 US disclosed
EP-2327766-B1 Nitrilases BASF ENZYMES LLC (US) 2015-12-02 EP disclosed
US-20090176976-A1 Increased activity and stability at increased pH and temperature VERENIUM CORPORATION 2009-07-09 US disclosed
US-20090176976-A1 Increased activity and stability at increased pH and temperature VERENIUM CORPORATION 2009-07-09 US disclosed
US-7521216-B2 Nitrilases and methods for making and using them VERENIUM CORPORATION (US) 2009-04-21 US disclosed
US-7521216-B2 Nitrilases and methods for making and using them VERENIUM CORPORATION (US) 2009-04-21 US disclosed
EP-2039762-A2 Nitralases Verenium Corporation (US) 2009-03-25 EP disclosed
US-4297489-A CEPHALOSPORINS BRISTOL-MYERS COMPANY (US) 1981-10-27 US disclosed
US-4172196-A CEPHALOSPORINS BRISTOL-MYERS COMPANY (US) 1979-10-23 US disclosed
US-4112228-A BACTERICIDES BRISTOL-MYERS COMPANY (US) 1978-09-05 US disclosed
US-3985738-A ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1976-10-12 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-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS TRPV4, TRPV1, TRPV2 LMNA 4199/4885MAPK1 1813/4885ALDH1A1 1663/4885
US-20110124909-A1 NOVEL PROCESS GABRE, GABRB2, GABRB1 LMNA 3715/4885MAPK1 3278/4885ALDH1A1 1268/4885
US-10857517-B2 Porous chiral materials and uses thereof ANXA7, XDH, OPRM1 LMNA 219/4885MAPK1 1200/4885ALDH1A1 928/4885

“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.