SCHEMBL912596

SCHEMBL912596

O=C(O)c1cc(F)cc([N+](=O)[O-])c1F

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.45
DTYMK P23919 1/20 0.45
TSHR P16473 3/20 0.42
CASP6 P55212 1/20 0.42
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.40
KEAP1 Q14145 1/20 0.39
LMNA P02545 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KCNMA1 Q12791 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 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
SCHEMBL4013929 0.85 TTR (0.45) TTRDTYMKTSHRCASP6TDP1
SCHEMBL204106 0.84 TTR (0.55) TTRDTYMKTSHRTDP1LMNA
SCHEMBL5219288 0.84 CA1 (0.53) TTRDTYMKTDP1LMNACA1
SCHEMBL21749958 0.84 CA1 (0.49) TTRDTYMKTSHRCASP6TDP1
SCHEMBL1039209 0.83 DTYMK (0.46) DTYMKTSHRCASP6TDP1ATM
SCHEMBL18342840 0.82 GPR35 (0.51) DTYMKTSHRCASP6TDP1LMNA
SCHEMBL30378797 0.82 DTYMK (0.42) TTRDTYMKTSHRCASP6ALDH1A1
SCHEMBL1461739 0.82 DTYMK (0.42) TTRDTYMKTSHRCASP6ALDH1A1
SCHEMBL30400653 0.82 GPR35 (0.51) DTYMKTSHRCASP6TDP1LMNA
SCHEMBL357671 0.82 DTYMK (0.46) TTRDTYMKTSHRCASP6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559492-B2 BRAF degraders C4 THERAPEUTICS, INC. (US) 2026-02-24 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
EP-4168407-A1 BRAF DEGRADERS C4 Therapeutics, Inc. (US) 2023-04-26 EP disclosed
CN-115996719-A BRAF degradation agent C4医药公司 2023-04-21 CN disclosed
WO-2021255212-A1 BRAF DEGRADERS F. HOFFMANN-LA ROCHE AG (CH) 2021-12-23 WO disclosed
WO-2014031872-A2 SMALL MOLECULE INHIBITORS FOR TREATING PARASITIC INFECTIONS THE BROAD INSTITUTE, INC. (US) 2014-02-27 WO disclosed
US-8394795-B2 Pyrazole [3, 4-B] pyridine Raf inhibitors ARRAY BIOPHARMA INC. (US) 2013-03-12 US disclosed
US-8338452-B2 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-25 US disclosed
EP-2265610-B1 PYRAZOLE [3, 4-B]PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC (US) 2012-12-12 EP disclosed
EP-2265574-A1 N- (6-AMINOPYRIDIN-3-YL) -3- (SULFONAMIDO) BENZAMIDE DERIVATIVES AS B-RAF INHIBITORS FOR THE TREATMENT OF CANCER Array Biopharma, Inc. (US) 2010-12-29 EP disclosed
WO-2009111277-A9 IMIDAZO [4. 5-B] PYRIDINE DERIVATIVES USED AS RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-12-30 WO disclosed
WO-2009111278-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed
WO-2009111280-A1 N- (6-AMINOPYRIDIN-3-YL) -3- (SULFONAMIDO) BENZAMIDE DERIVATIVES AS B-RAF INHIBITORS FOR THE TREATMENT OF CANCER ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed
WO-2009111279-A1 PYRAZOLE [3, 4-B] PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed
WO-2009111277-A1 IMDIZO [4. 5-B] PYRIDINE DERIVATIVES USED AS RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed
US-20050288273-A1 Antibacterial agents BOYER FREDERICK E JR 2005-12-29 US disclosed
EP-1594865-A2 ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2005-11-16 EP disclosed
WO-2004069832-A2 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2004-08-19 WO disclosed
US-3931303-A Process for preparing 5-halo-2,3-phenylenediamine-1-carboxylic acid GAF CORPORATION (US) 1976-01-06 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-12559492-B2 BRAF degraders BRAF, NRAS, HRAS TTR 2193/4885DTYMK 1628/4885TSHR 75/4885
US-20230145336-A1 BRAF DEGRADERS BRAF, NRAS, RAF1 TTR 2024/4885DTYMK 283/4885TSHR 821/4885
US-20050288273-A1 Antibacterial agents MRPL21, RPN2, FBL TTR 3801/4885DTYMK 1671/4885TSHR 4486/4885

“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.