SCHEMBL841590

SCHEMBL841590

CC(=O)c1ccc(F)c(B(O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KIF11 P52732 1/20 0.41
CYP2A6 P11509 1/20 0.40
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PKM P14618 1/20 0.39
PRKCI P41743 1/20 0.38
S100A4 P26447 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
SCHEMBL15962141 0.85 KIF11 (0.55) MAOBMAOAMAPTKIF11LMNA
SCHEMBL3502920 0.84 ALDH1A1 (0.42) CES2CES1MAOBMAPTNPC1
SCHEMBL31224923 0.84 LMNA (0.50) CES2CES1MAPTRAB9AALDH1A1
SCHEMBL4037801 0.84 LMNA (0.50) CES2CES1MAPTRAB9AALDH1A1
SCHEMBL973928 0.82 PARP1 (0.50) CES2CES1ALDH1A1
SCHEMBL3995737 0.79 HDAC6 (0.46) HPGD
SCHEMBL701513 0.79 CA1 (0.50) MAPTNPC1RAB9AHPGDALDH1A1
SCHEMBL29626852 0.79 CA1 (0.50) MAPTNPC1RAB9AHPGDALDH1A1
SCHEMBL6522758 0.79 ERN1 (0.50) CES2CES1HPGDALDH1A1
SCHEMBL29919394 0.79 HDAC6 (0.46) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116425782-A Preparation method of 5-acetyl-2-fluorobenzeneboronic acid pinacol ester 烟台盛凯伦化学科技有限公司 2023-07-14 CN claimed
CN-113584890-A Preparation method of anti-wrinkle wool fabric 吴江市南麻恒兴丝织厂 2021-11-02 CN claimed
US-20250206724-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2025-06-26 US disclosed
US-20250066308-A1 BICYCLIC FUSED RING DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME YUHAN CORPORATION (KR) 2025-02-27 US disclosed
EP-4499612-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2025-02-05 EP disclosed
EP-4397655-A1 BICYCLIC FUSED RING DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Yuhan Corporation (KR) 2024-07-10 EP disclosed
WO-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 WO disclosed
CN-116425782-A Preparation method of 5-acetyl-2-fluorobenzeneboronic acid pinacol ester 烟台盛凯伦化学科技有限公司 2023-07-14 CN disclosed
CN-116425782-A Preparation method of 5-acetyl-2-fluorobenzeneboronic acid pinacol ester 烟台盛凯伦化学科技有限公司 2023-07-14 CN disclosed
CN-115974934-A Synthesis method and application of platinum complex with different configurations regulated and controlled by chlorine source 海南师范大学 2023-04-18 CN disclosed
WO-2023055124-A1 BICYCLIC FUSED RING DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사유한양행 2023-04-06 WO disclosed
US-20090215778-A1 Alpha-substituted Arylmethyl Piperazine Pyrazolo [1,5-alpha]Pyrimidine Amide Derivatives PANACOS PHARMACEUTICALS, INC. (US) 2009-08-27 US disclosed
WO-2009102736-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2009-08-20 WO disclosed
US-20090209476-A1 Insecticide (against arthropods), nematocide; use against pesticide-resistant pests; use on plants and animals; Compounds are tetrahydropyrans substituted with an aryl-heteroaryl-aryl-containing group DOW AGROSCIENCES LLC (US) 2009-08-20 US disclosed
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. 2009-08-06 US disclosed
US-20090088444-A1 Substituted phenanthrene diketo acids and uses therefor BUOLAMWINI JOHN K 2009-04-02 US disclosed
US-20090074717-A1 Anti-viral compounds, compositions, and methods of use GLAXOSMITHKLINE LLC 2009-03-19 US disclosed
WO-2009011787-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. (US) 2009-01-22 WO disclosed
WO-2009007015-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2009-01-15 WO disclosed
WO-2008134036-A1 ALPHA-SUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-α]PYRIMIDINE AMIDE DERIVATIVES PANACOS PHARMACEUTICALS, INC. (US) 2008-11-06 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-20250066308-A1 BICYCLIC FUSED RING DERIVATIVE OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME LOX, XDH, IL4I1 CES2 1602/4885CES1 113/4885MAOB 252/4885
US-20090209476-A1 Insecticide (against arthropods), nematocide; use against pesticide-resistant pests; use on plants and animals; Compounds are tetrahydropyrans substituted with an aryl-heteroaryl-aryl-containing group DDT, ACHE, NANP CES2 116/4885CES1 242/4885MAOB 1349/4885
US-20090215778-A1 Alpha-substituted Arylmethyl Piperazine Pyrazolo [1,5-alpha]Pyrimidine Amide Derivatives THPO, DPYD, TPMT CES2 1375/4885CES1 851/4885MAOB 2026/4885
US-20090088444-A1 Substituted phenanthrene diketo acids and uses therefor WEE1, WEE2, HADHB CES2 1533/4885CES1 615/4885MAOB 2906/4885
US-20090074717-A1 Anti-viral compounds, compositions, and methods of use HAVCR2, SARS1, RPL35 CES2 401/4885CES1 501/4885MAOB 1138/4885
US-20250206724-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS CDK1, CDK11A, CDK3 CES2 4614/4885CES1 3219/4885MAOB 3695/4885
US-20090197880-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE HAVCR2, SARS1, RPL35 CES2 401/4885CES1 501/4885MAOB 1138/4885

“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.