SCHEMBL119830

SCHEMBL119830

Nc1ncc(C(F)(F)F)cc1Br

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
HTT P42858 2/20 0.54
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
NOS3 P29474 1/20 0.39
NOS2 P35228 1/20 0.39
PLAU P00749 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 1/20 0.36
AGBL2 Q5U5Z8 1/20 0.35
GAA P10253 1/20 0.35
MAP4K4 O95819 1/20 0.35
THRB P10828 1/20 0.34

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
SCHEMBL24738936 0.84 HTT (0.50) KMT2AHTTALDH1A1SMN1; SMN2KDM4E
SCHEMBL10354420 0.83 ALDH1A1 (0.39) HTTALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL30549668 0.79 ALDH1A1 (0.42) KMT2AHTTALDH1A1SMN1; SMN2KDM4E
SCHEMBL18299209 0.79 ALDH1A1 (0.42) KMT2AHTTALDH1A1SMN1; SMN2KDM4E
SCHEMBL31358204 0.79 HTT (0.54) KMT2AHTTALDH1A1KDM4EPOLB
SCHEMBL1716472 0.78 ALDH1A1 (0.44) KMT2AALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL30762204 0.78 ALDH1A1 (0.44) KMT2AALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL1336778 0.78 ALDH1A1 (0.39) HTTALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL31153021 0.78 ALDH1A1 (0.39) HTTALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL1348639 0.78 MAP4K4 (0.55) KMT2AHTTALDH1A1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583871-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2026-03-24 US disclosed
EP-4688772-A1 BIARYL DERIVATIVES AND RELATED USES Moma Therapeutics, Inc. (US) 2026-02-11 EP disclosed
EP-4076460-B1 1,4-DIHYDRO-2H-SPIRO[ISOQUINOLINE-3,4'-PIPERIDINE DERIVATIVES AS PRMT5 INHIBITORS FOR THE TREATMENT OF CANCER MERCK SHARP & DOHME LLC (US) 2026-01-21 EP disclosed
US-20260015360-A1 BIARYL DERIVATIVES AND RELATED USES MOMA THERAPEUTICS, INC. 2026-01-15 US disclosed
US-12441730-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2025-10-14 US disclosed
US-12421222-B2 Substituted quinazolines as HDAC6 inhibitors AUGUSTINE THERAPEUTICS (BE) 2025-09-23 US disclosed
US-20250276967-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES SIGNAL PHARMACEUTICALS, LLC 2025-09-04 US disclosed
US-12338235-B2 Heterocyclic compounds and their use for treatment of helminthic infections and diseases CELGENE CORPORATION (US) 2025-06-24 US disclosed
US-20250145604-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-05-08 US disclosed
US-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-02-13 US disclosed
US-6001843-A Substituted pyridines as selective cyclooxygenase-2 inhibitors MERCK & CO., INC. (US) 1999-12-14 US disclosed
EP-0912518-A1 SUBSTITUTED PYRIDINES AS SELECTIVE CYCLOOXYGENASE-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1999-05-06 EP disclosed
WO-1999020110-A1 COMBINATION THERAPY FOR REDUCING THE RISKS ASSOCIATED WITH CARDIO- AND CEREBROVASCULAR DISEASE MERCK & CO., INC. (US) 1999-04-29 WO disclosed
WO-1999014195-A1 2-AMINOPYRIDINES AS INHIBITORS OF CYCLOOXYGENASE-2 MERCK FROSST CANADA & CO. (CA) 1999-03-25 WO disclosed
WO-1999014194-A1 2,3,5-TRISUBSTITUTED PYRIDINES AS INHIBITORS OF CYCLOOXYGENASE-2 MERCK FROSST CANADA & CO. (CA) 1999-03-25 WO disclosed
US-5861419-A ANTIINFLAMMATORY AGENTS; ANTIPYRETICS, ANALGESICS; ETORICOXIB PATENT MERCK FROSST CANAD, INC. (CA) 1999-01-19 US disclosed
WO-1998003484-A1 SUBSTITUTED PYRIDINES AS SELECTIVE CYCLOOXYGENASE-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1998-01-29 WO disclosed
EP-0031218-B1 A 2-AMINO-TRIFLUOROMETHYL-HALOGENOPYRIDINE COMPOUND AND A PROCESS FOR PRODUCING THE SAME ISHIHARA SANGYO KAISHA LTD. (JP) 1983-05-11 EP disclosed
US-4349681-A 2-Amino-3-chloro-5-trifluoromethylpyridine ISHIHARA SANGYO KAISHA, LTD. (JP) 1982-09-14 US disclosed
EP-0031218-A1 A 2-amino-trifluoromethyl-halogenopyridine compound and a process for producing the same ISHIHARA SANGYO KAISHA LTD. (JP) 1981-07-01 EP 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 (8 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-20260015360-A1 BIARYL DERIVATIVES AND RELATED USES POLB, POLA1, POLN KMT2A 3600/4885HTT 3171/4885ALDH1A1 824/4885
US-20250276967-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CYP8B1, HAX1, HRH4 KMT2A 3502/4885HTT 91/4885ALDH1A1 1513/4885
US-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS HDAC6, HDAC9, HDAC1 KMT2A 451/4885HTT 66/4885ALDH1A1 608/4885
US-20250145604-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS HDAC6, HDAC9, HDAC1 KMT2A 451/4885HTT 66/4885ALDH1A1 608/4885
US-12338235-B2 Heterocyclic compounds and their use for treatment of helminthic infections and diseases CYP8B1, HAX1, HRH4 KMT2A 3502/4885HTT 91/4885ALDH1A1 1513/4885
US-12421222-B2 Substituted quinazolines as HDAC6 inhibitors HDAC6, HDAC9, HDAC1 KMT2A 438/4885HTT 96/4885ALDH1A1 850/4885
US-12441730-B2 PRMT5 inhibitors PRMT5, PRMT1, PRMT3 KMT2A 103/4885HTT 1340/4885ALDH1A1 1341/4885
US-12583871-B2 PRMT5 inhibitors PRMT5, PRMT1, PRMT3 KMT2A 110/4885HTT 928/4885ALDH1A1 1190/4885

“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.