SCHEMBL4443708

SCHEMBL4443708

COC(=O)c1cc(CBr)ccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50
PARP1 P09874 1/20 0.49
ALDH1A1 P00352 2/20 0.47
AR P10275 1/20 0.46
ACACB O00763 1/20 0.44
MAPK1 P28482 1/20 0.41
SMYD3 Q9H7B4 1/20 0.41
KDM4E B2RXH2 2/20 0.41
KDM6B O15054 1/20 0.41
KDM5C P41229 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
KDM3A Q9Y4C1 1/20 0.41
PKM P14618 2/20 0.40
LCK P06239 1/20 0.40
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
PDE5A O76074 1/20 0.38
LMNA P02545 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
SCHEMBL30542743 1.00 CYP4F2 (0.50) CYP4F2CYP4A11PARP1ALDH1A1AR
SCHEMBL30600807 0.86 SMYD3 (0.52) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL5234628 0.86 SMYD3 (0.52) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL29479667 0.85 PARP1 (0.50) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL502256 0.85 PARP1 (0.50) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL480291 0.84 CYP4F2 (0.52) CYP4F2CYP4A11ALDH1A1MAPK1KDM4E
SCHEMBL4441732 0.83 LOXL2 (0.55) PARP1ALDH1A1ARACACBSMYD3
SCHEMBL127718 0.83 PARP1 (0.49) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL30740810 0.83 ALDH1A1 (0.50) PARP1ALDH1A1ARACACBMAPK1
SCHEMBL7083009 0.83 PARP1 (0.49) PARP1ALDH1A1ARACACBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250171461-A1 STIMULATOR OF INTERFERON GENES (STING) MODULATORS, AND COMPOSITIONS AND METHODS THEREOF GEODE THERAPEUTICS INC (US) 2025-05-29 US disclosed
EP-4482839-A2 STIMULATOR OF INTERFERON GENES (STING) MODULATORS, AND COMPOSITIONS AND METHODS THEREOF Geode Therapeutics Inc. (US) 2025-01-01 EP disclosed
WO-2023158862-A2 STIMULATOR OF INTERFERON GENES (STING) MODULATORS, AND COMPOSITIONS AND METHODS THEREOF GEODE THERAPEUTICS INC. (US) 2023-08-24 WO disclosed
WO-2023158862-A2 STIMULATOR OF INTERFERON GENES (STING) MODULATORS, AND COMPOSITIONS AND METHODS THEREOF GEODE THERAPEUTICS INC. (US) 2023-08-24 WO disclosed
US-20220267298-A1 QUINAZOLIN-4-ONE DERIVATIVES USEFUL AS GRK2 INHIBITORS JANSSEN RESEARCH & DEVELOPMENT, LLC 2022-08-25 US disclosed
WO-2022133064-A1 FUSED PYRIMIDINE COMPOUNDS AS INHIBITORS OF MENIN-MLL INTERACTION BIOMEA FUSION, INC. (US) 2022-06-23 WO disclosed
WO-2021018948-A1 QUINAZOLIN-4-ONE DERIVATIVES USEFUL AS GRK2 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-02-04 WO disclosed
EP-2686305-B1 QUINAZOLINEDIONES AND THEIR USE IMPACT THERAPEUTICS INC (CN) 2020-09-16 EP disclosed
US-20190031618-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2019-01-31 US disclosed
US-10188653-B2 Diacylglycerol acyltransferase 2 inhibitors PFIZER INC. (US) 2019-01-29 US disclosed
WO-2014031928-A2 HETEROCYCLIC MODULATORS OF HIF ACTIVITY FOR TREATMENT OF DISEASE JONES PHILIP (US) 2014-02-27 WO disclosed
US-20140031358-A1 QUINAZOLINEDIONES AND THEIR USE Eternity Bioscience Inc. (US) 2014-01-30 US disclosed
US-20140031358-A1 QUINAZOLINEDIONES AND THEIR USE Eternity Bioscience Inc. (US) 2014-01-30 US disclosed
WO-2012125521-A1 QUINAZOLINEDIONES AND THEIR USE Eternity Bioscience Inc. (US) 2012-09-20 WO disclosed
WO-2010007800-A1 NOVEL URACIL COMPOUND HAVING AMIDE STRUCTURE AND SALT THEREOF 大鵬薬品工業株式会社 (JP) 2010-01-21 WO disclosed
US-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 US disclosed
US-20030229079-A1 1-(Aromatic- or heteroaromatic-substituted)-3-(heteroaromatic substituted)-1,3-propanediones and uses thereof PAYNE LINDA S (US) 2003-12-11 US disclosed
EP-1196384-A4 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF MERCK & CO INC (US) 2002-10-23 EP disclosed
EP-1196384-A1 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF Merck & Co., Inc. (US) 2002-04-17 EP disclosed
WO-2001000578-A1 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF MERCK & CO., INC. (US) 2001-01-04 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 (7 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-20250171461-A1 STIMULATOR OF INTERFERON GENES (STING) MODULATORS, AND COMPOSITIONS AND METHODS THEREOF STING1, IRF3, CGAS CYP4F2 4590/4885CYP4A11 3064/4885PARP1 1850/4885
US-20220267298-A1 QUINAZOLIN-4-ONE DERIVATIVES USEFUL AS GRK2 INHIBITORS GRK2, GRK4, GRK3 CYP4F2 966/4885CYP4A11 956/4885PARP1 2761/4885
US-20190031618-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS CNR1, GPR119, CNR2 CYP4F2 1159/4885CYP4A11 535/4885PARP1 2835/4885
US-10188653-B2 Diacylglycerol acyltransferase 2 inhibitors DGAT2, LCLAT1, DGAT1 CYP4F2 1738/4885CYP4A11 3079/4885PARP1 2860/4885
US-20030229079-A1 1-(Aromatic- or heteroaromatic-substituted)-3-(heteroaromatic substituted)-1,3-propanediones and uses thereof CYP2S1, IMPDH1, IDO1 CYP4F2 1592/4885CYP4A11 595/4885PARP1 335/4885
US-20140031358-A1 QUINAZOLINEDIONES AND THEIR USE PARP1, PARP15, PARP11 CYP4F2 1024/4885CYP4A11 723/4885PARP1 1/4885
US-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 CYP4F2 3246/4885CYP4A11 2240/4885PARP1 788/4885

“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.