SCHEMBL638889

SCHEMBL638889

Clc1c(Cl)c2c(Cl)ccc3c4cccc5cccc(c(c1Cl)c23)c54

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.41
CYP1A2 P05177 7/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
HSD17B10 Q99714 4/20 0.40
THRB P10828 1/20 0.40
AHR P35869 2/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
AR P10275 1/20 0.33
TSHR P16473 4/20 0.32
CYP3A4 P08684 2/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
TDP1 Q9NUW8 2/20 0.32

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
SCHEMBL29565545 1.00 CYP2A6 (0.41) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
Bicarbonate SCHEMBL10434768 0.92 KMT2A (0.41) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL9153299 0.85 GAA (0.36) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL9516220 0.85 RXFP1 (0.37) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
Bicarbonate SCHEMBL11122358 0.84 KDM4E (0.35) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL6761903 0.84 CYP1A2 (0.44) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL15516851 0.81 CYP1A2 (0.42) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL29264883 0.79 CYP1A2 (0.58) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL825527 0.79 CYP1A2 (0.58) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL31519796 0.79 CYP1A2 (0.58) CYP2A6CYP1A2ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120015949-A Lithium battery pack with excellent cycle performance and preparation method thereof 东莞市宝博电子有限公司 2025-05-16 CN claimed
CN-114380826-B Perylene porous organic salt material with stable light and heat properties, and preparation method and application thereof 吉林大学 2024-02-23 CN claimed
CN-117447699-A Preparation method and application of nanometer dendritic polymer fluorescent probe 北京化工大学 2024-01-26 CN claimed
CN-108047221-B Perylene diimide compound, synthesis method thereof and application thereof in H 2 O 2 Application in detection 山东省医学科学院药物研究所 2023-08-01 CN claimed
CN-115975191-A Thermosetting silicon-containing polyimide resin prepolymer, resin and preparation method thereof 山东省科学院新材料研究所 2023-04-18 CN claimed
CN-115109059-A Asymmetric diamino triazine substituted perylene bisimide and synthesis method thereof 华南理工大学 2022-09-27 CN claimed
CN-112029100-B Perylene anhydride type polyarylene sulfide with tree structure and preparation method and application thereof 四川大学 2022-02-08 CN claimed
US-20100043878-A1 LUMINESCENT SOLAR COLLECTOR SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-02-25 US claimed
US-20100043879-A1 LUMINESCENT SOLAR COLLECTOR SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2010-02-25 US claimed
CN-1272639-C Scintillator panel HAMAMATSU PHOTONICS KK (JP) 2006-08-30 CN claimed
EP-4603548-A1 FLUORESCENT MATERIALS Iyris Technology Limited (GB) 2025-08-20 EP disclosed
CN-119735732-B Synthesis method of rhodamine polymer super-resolution nano probe 浙江工业大学 2025-06-24 CN disclosed
CN-120015949-A Lithium battery pack with excellent cycle performance and preparation method thereof 东莞市宝博电子有限公司 2025-05-16 CN disclosed
CN-119735732-A Synthesis method of rhodamine polymer super-resolution nano probe 浙江工业大学 2025-04-01 CN disclosed
EP-3665172-B1 COMPOUNDS AS POTENTIAL DYE MOLECULES Lleaf Pty Ltd (AU) 2025-03-19 EP disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 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 (2 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-20100043878-A1 LUMINESCENT SOLAR COLLECTOR CRY1, CRY2, TYR CYP2A6 1398/4885CYP1A2 369/4885ALDH1A1 246/4885
US-20100043879-A1 LUMINESCENT SOLAR COLLECTOR IK, XPA, MAPRE2 CYP2A6 3258/4885CYP1A2 1976/4885ALDH1A1 1587/4885

“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.