SCHEMBL1448201

SCHEMBL1448201

COC(=O)c1cc([N+](=O)[O-])cc(F)c1Br

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
MAPT P10636 5/20 0.43
LMNA P02545 4/20 0.43
HTT P42858 4/20 0.43
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38
OPRK1 P41145 1/20 0.37

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
SCHEMBL15081285 0.84 ALDH1A1 (0.45) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL30353758 0.84 ALDH1A1 (0.45) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL31451989 0.84 ALDH1A1 (0.45) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL20298750 0.84 NPC1 (0.50) ALDH1A1MAPTLMNANPC1POLB
SCHEMBL28306231 0.83 ALDH1A1 (0.44) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL4196549 0.83 ALDH1A1 (0.45) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL13987139 0.83 ALDH1A1 (0.50) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL12548246 0.83 MAPT (0.44) ALDH1A1MAPTLMNAHTTNPC1
SCHEMBL25249572 0.82 ALDH1A1 (0.43) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL3720610 0.82 ALDH1A1 (0.43) ALDH1A1MAPTLMNAHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260008791-A1 CHEMICAL COMPOUNDS BORAH INC (US) 2026-01-08 US disclosed
US-12358932-B2 Chemical compounds BORAH, INC. (US) 2025-07-15 US disclosed
CN-119731169-A Sodium channel regulator and application thereof 上海汇伦医药股份有限公司 2025-03-28 CN disclosed
US-20240368196-A1 CHEMICAL COMPOUNDS BORAH, INC. 2024-11-07 US disclosed
CN-114341145-B Chemical compound 博拉公司 2024-08-16 CN disclosed
WO-2024046253-A1 SODIUM CHANNEL REGULATOR AND USE THEREOF 上海汇伦医药股份有限公司 2024-03-07 WO disclosed
CN-117242080-A Boron-containing pyrazole compounds, compositions comprising the same, methods and uses thereof 勃林格殷格翰动物保健美国公司 2023-12-15 CN disclosed
US-11827657-B2 Boron containing pyrazole compounds, compositions comprising them, methods and uses thereof Boehringer Ingelheim Animal Health USA Inc. (US) 2023-11-28 US disclosed
US-11827657-B2 Boron containing pyrazole compounds, compositions comprising them, methods and uses thereof Boehringer Ingelheim Animal Health USA Inc. (US) 2023-11-28 US disclosed
WO-2022133420-A1 BORON CONTAINING PYRAZOLE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF Boehringer Ingelheim Animal Health USA Inc. (US) 2022-06-23 WO disclosed
US-7910585-B2 Pyrimidine derivatives NOVARTIS AG (CH) 2011-03-22 US disclosed
US-7910585-B2 Pyrimidine derivatives NOVARTIS AG (CH) 2011-03-22 US disclosed
WO-2011025565-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2011-03-03 WO disclosed
WO-2010133312-A1 HALOGEN-SUBSTITUTED COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-11-25 WO disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
US-20080293708-A1 Pyrimidine Derivatives NOVARTIS AG (CH) 2008-11-27 US disclosed
CN-101006079-A Pyrimidine derivatives NOVARTIS AG (CH) 2007-07-25 CN disclosed
EP-1784399-A2 PYRIMIDINE DERIVATIVES Novartis AG (CH) 2007-05-16 EP disclosed
WO-2006021457-A2 PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2006-03-02 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-20260008791-A1 CHEMICAL COMPOUNDS JAK3, JAK2, JAK1 ALDH1A1 2401/4885MAPT 4400/4885LMNA 4610/4885
US-11827657-B2 Boron containing pyrazole compounds, compositions comprising them, methods and uses thereof JAK3, JAK1, JAK2 ALDH1A1 3977/4885MAPT 2548/4885LMNA 4698/4885
US-20240368196-A1 CHEMICAL COMPOUNDS PDE4A, PDE4B, SYK ALDH1A1 2613/4885MAPT 2233/4885LMNA 4874/4885
US-20080293708-A1 Pyrimidine Derivatives DPYD, TYMP, TYMS ALDH1A1 955/4885MAPT 2574/4885LMNA 3279/4885
US-12358932-B2 Chemical compounds PDE4A, PDE4B, SYK ALDH1A1 2613/4885MAPT 2233/4885LMNA 4874/4885

“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.