SCHEMBL649996

SCHEMBL649996

O=C(C(=O)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 12/20 0.80
CES1 P23141 11/20 0.80
AKR1C3 P42330 1/20 0.55
RAB9A P51151 3/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 2/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CYP1B1 Q16678 1/20 0.52
MAPT P10636 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL557285 0.89 CES2 (1.00) CES2CES1RAB9AMEN1KMT2A
SCHEMBL17652903 0.89 CES2 (0.70) CES2CES1AKR1C3RAB9ANPC1
SCHEMBL11126420 0.88 CES2 (0.61) CES2CES1RAB9ANPC1HPGD
SCHEMBL1195835 0.87 CES2 (1.00) CES2CES1RAB9A
Benzil SCHEMBL4957522 0.87 CES2 (1.00) CES2CES1RAB9A
SCHEMBL4187858 0.86 CES2 (0.73) CES2CES1MEN1KMT2ATP53
Benzophenone SCHEMBL11774383 0.85 ALDH1A1 (0.70) CES2CES1AKR1C3RAB9AMEN1
Benzoic Acid SCHEMBL28594970 0.85 TSHR (0.70) CES2CES1AKR1C3RAB9AMEN1
SCHEMBL69395 0.85 ALDH1A1 (0.70) CES2CES1AKR1C3RAB9AMEN1
SCHEMBL6251174 0.85 CES2 (0.64) CES2CES1AKR1C3RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066584-A1 PHOTOINITIATORS, COMPOSITIONS, AND METHODS OF FORMING AN OBJECT QUADRATIC 3D, INC. 2025-02-27 US disclosed
EP-4508492-A1 PHOTOINITIATORS, COMPOSITIONS, AND METHODS OF FORMING AN OBJECT Quadratic 3D, Inc. (US) 2025-02-19 EP disclosed
CN-119487450-A Photoinitiator, composition and method for forming object 二次3D股份有限公司 2025-02-18 CN disclosed
WO-2024186326-A1 PHOTOINITIATORS, COMPOSITIONS, AND METHODS OF FORMING AN OBJECT QUADRATIC 3D, INC. (US) 2024-09-12 WO disclosed
CN-111635300-B Method for preparing deuterated benzoin by taking heavy water as deuterium source 云南民族大学 2024-05-28 CN disclosed
CN-116478101-A Triptycene condensed pyrazine derivative and preparation method and application thereof 厦门稀土材料研究所 2023-07-25 CN disclosed
WO-2023097386-A1 SELECTIVE HDAC6-INHIBITING N-ACYLHYDRAZONE COMPOUNDS, METHODS FOR PRODUCING SAME, COMPOSITIONS, USES, TREATMENT METHODS AND KITS EUROFARMA LABORATÓRIOS S.A (BR) 2023-06-08 WO disclosed
CN-112920065-B Benzil compound and preparation method and application thereof 上海中医药大学 2023-04-25 CN disclosed
CN-106133112-B Light-emitting material, organic light-emitting element, and compound 九州有机光材股份有限公司 2019-05-14 CN disclosed
US-10256415-B2 Light-emitting material, organic light-emitting device, and compound KYULUX, INC. (JP) 2019-04-09 US disclosed
US-6288188-B1 ACETYLENIC POLYMERS; INTEGRATED CIRCUITS, DIELECTRICS, MICROELECTRONICS THE DOW CHEMICAL COMPANY 2001-09-11 US disclosed
US-6225132-B1 DERIVATIZING AGENT COMPRISING A MULTIPHOTON-EMITTING RADIOISOTOPE AND A MOIETY THAT FORMS A NON-COVALENT CHEMICAL BOND WITH AN ANALYTE OF INTEREST, SUITABLE FOR DETECTION OF THE ANALYTE OF INTEREST BIOTRACES, INC. 2001-05-01 US disclosed
US-5965679-A BASED A BISCYCLOPENTADIENONE AND AN AROMATIC DIACETYLENE; CURING; LOW DIELECTRIC; INTEGRATED CIRCUITS; MICROELECTRONICS; PRINTED CIRCUITS THE DOW CHEMICAL COMPANY (US) 1999-10-12 US disclosed
EP-0912899-A1 ENHANCED CHROMATOGRAPHY USING MULTIPHOTON DETECTION Biotraces, Inc. (US) 1999-05-06 EP disclosed
EP-0889920-A1 POLYPHENYLENE OLIGOMERS AND POLYMERS THE DOW CHEMICAL COMPANY (US) 1999-01-13 EP disclosed
US-5854084-A Enhanced chromatography using multiphoton detection BIOTRACES, INC. (US) 1998-12-29 US disclosed
WO-1998011149-A1 POLYPHENYLENE OLIGOMERS AND POLYMERS THE DOW CHEMICAL COMPANY (US) 1998-03-19 WO disclosed
WO-1998002750-A1 ENHANCED CHROMATOGRAPHY USING MULTIPHOTON DETECTION BIOTRACES, INC. (US) 1998-01-22 WO disclosed
US-4071570-A ANTIARRHYTHMIC AGENTS MERCK & CO., INC. (US) 1978-01-31 US disclosed
US-3978127-A ANTIARRHYTHMIC MERCK & CO., INC. (US) 1976-08-31 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 (1 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-10256415-B2 Light-emitting material, organic light-emitting device, and compound H1-0, CRY1, CRY2 CES2 2114/4885CES1 3762/4885AKR1C3 4319/4885

“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.