SCHEMBL147850

SCHEMBL147850

COc1ccc(CO)c(Br)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.47
CA4 P22748 5/20 0.47
CA1 P00915 6/20 0.42
CA6 P23280 4/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
AOC3 Q16853 1/20 0.41
PTPN1 P18031 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
CYP1A2 P05177 1/20 0.38
CHRM2 P08172 1/20 0.38
SLC6A4 P31645 1/20 0.38
OPRD1 P41143 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
SCHEMBL30829272 1.00 CA2 (0.47) CA2CA4CA1CA6PDE4A
SCHEMBL27856838 0.82 CA2 (0.44) CA2CA4CA1CA6AOC3
SCHEMBL11211183 0.82 AOC3 (0.41) CA2CA4CA1CA6AOC3
SCHEMBL1340134 0.82 AOC3 (0.53) PDE4APDE4BPDE4CPDE4DAOC3
SCHEMBL194960 0.81 CA2 (0.42) CA2CA4CA1CA6AOC3
SCHEMBL30505690 0.81 PDE4A (0.42) CA2CA4CA1CA6PDE4A
SCHEMBL6805249 0.81 CA2 (0.42) CA2CA4CA1CA6AOC3
SCHEMBL2024931 0.81 CA2 (0.49) CA2CA4CA1CA6PDE4A
SCHEMBL31681726 0.80 KDM4E (0.50) MEN1KMT2AKDM4E
SCHEMBL11210250 0.79 CYP3A4 (0.50) CA2CA4CA1CA6PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113559904-B Application of nitrogen-carbon material anchored iron single-atom catalyst in catalyzing ammoxidation of alcohol to prepare nitrile 南京理工大学 2024-04-02 CN claimed
CN-113559904-A Application of nitrogen-carbon material anchored iron monatomic catalyst in reaction for catalyzing ammoxidation of alcohol to prepare nitrile 南京理工大学 2021-10-29 CN claimed
CN-105001107-B A kind of method of synthesizing methyl Hongmaoxinjian 西安交通大学 2016-08-17 CN claimed
CN-105001107-A Synthetic method for methyl caulophine UNIV XI AN JIAOTONG 2015-10-28 CN claimed
US-20250154106-A1 ABIETANES AND METHODS OF MAKING AND USING THE SAME NATIONAL INSTITUTES OF HEALTH 2025-05-15 US disclosed
US-12221419-B2 Abietanes and methods of making and using the same FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2025-02-11 US disclosed
EP-4499055-A2 ABIETANES AND METHODS OF MAKING AND USING THE SAME The Florida State University Research Foundation, Incorporated (US) 2025-02-05 EP disclosed
US-20240140912-A1 ABIETANES AND METHODS OF MAKING AND USING THE SAME NATIONAL INSTITUTES OF HEALTH 2024-05-02 US disclosed
CN-113559904-B Application of nitrogen-carbon material anchored iron single-atom catalyst in catalyzing ammoxidation of alcohol to prepare nitrile 南京理工大学 2024-04-02 CN disclosed
WO-2023192921-A2 ABIETANES AND METHODS OF MAKING AND USING THE SAME THE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INCORPORATED (US) 2023-10-05 WO disclosed
CN-113559904-A Application of nitrogen-carbon material anchored iron monatomic catalyst in reaction for catalyzing ammoxidation of alcohol to prepare nitrile 南京理工大学 2021-10-29 CN disclosed
CN-105001107-B A kind of method of synthesizing methyl Hongmaoxinjian 西安交通大学 2016-08-17 CN disclosed
US-20130109713-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY 2013-05-02 US disclosed
US-20120059026-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-08 US disclosed
US-20120059026-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-08 US disclosed
WO-2011163610-A2 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-29 WO disclosed
WO-2011159926-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-22 WO disclosed
WO-2011156626-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-15 WO disclosed
WO-2010127307-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-11-04 WO disclosed
WO-2010127307-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-11-04 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 (5 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-20130109713-A1 ANTIMICROBIAL AGENTS RPS4X, RPS4Y1, MRPL21 CA2 2798/4885CA4 2634/4885CA1 4586/4885
US-20120059026-A1 ANTIMICROBIAL AGENTS ZYX, Q6ZSR9, ZC3HAV1L CA2 1379/4885CA4 413/4885CA1 3802/4885
US-20250154106-A1 ABIETANES AND METHODS OF MAKING AND USING THE SAME SYMPK, TXK, HYPK CA2 2614/4885CA4 1312/4885CA1 1373/4885
US-20240140912-A1 ABIETANES AND METHODS OF MAKING AND USING THE SAME SYMPK, TXK, HYPK CA2 2614/4885CA4 1312/4885CA1 1373/4885
US-12221419-B2 Abietanes and methods of making and using the same SYMPK, TXK, HYPK CA2 2614/4885CA4 1312/4885CA1 1373/4885

“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.