SCHEMBL1602273

SCHEMBL1602273

Oc1ccc2ccccc2c1I

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN22 Q9Y2R2 1/20 0.60
▸ POLB P06746 1/20 0.56
▸ HSD17B10 Q99714 3/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ USP2 O75604 1/20 0.54
▸ PAK1 Q13153 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ GAA P10253 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ CYP2A6 P11509 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ TAAR1 Q96RJ0 1/20 0.50
▸ ERN1 O75460 1/20 0.50
▸ IDO1 P14902 1/20 0.48
▸ HPRT1 P00492 1/20 0.46
▸ GLA P06280 1/20 0.46

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
Methane SCHEMBL28321488 0.98 PTPN22 (0.58) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL25221463 0.80 ALOX5 (0.48) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL28013806 0.80 HPRT1 (0.52) PTPN22POLBHSD17B10CYP1A2USP2
1-Naphthol SCHEMBL27453648 0.77 CYP1A2 (0.65) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL24519126 0.77 NPC1 (0.47) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL29027 0.75 PTPN22 (0.65) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL29613822 0.75 PTPN22 (1.00) PTPN22POLBHSD17B10CYP1A2USP2
Hydrochloric Acid SCHEMBL28347175 0.75 PTPN22 (1.00) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL29362162 0.75 PTPN22 (0.65) PTPN22POLBHSD17B10CYP1A2USP2
SCHEMBL28483 0.75 PTPN22 (1.00) PTPN22POLBHSD17B10CYP1A2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106748604-B Method for synthesizing mono-iodo aromatic hydrocarbon or di-iodo aromatic hydrocarbon based on decarboxylation of aromatic carboxylic acid 湘潭大学 2020-06-05 — — CN claimed
CN-119662037-A Preparation method of blue dye 沈阳化工研究院有限公司 2025-03-21 — — CN disclosed
US-20240025872-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2024-01-25 — — US disclosed
US-20240025872-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2024-01-25 — — US disclosed
CN-117327110-A Compound taking boron as center and naphthofuran as framework and electroluminescent device 蒲城欧得新材料有限公司 2024-01-02 — — CN disclosed
CN-116988078-A Metal catalyzed asymmetric coupling method promoted by electrochemical reduction 中国科学院上海有机化学研究所 2023-11-03 — — CN disclosed
EP-4249478-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT Materials Co., Ltd. (KR) 2023-09-27 — — EP disclosed
EP-3848363-B1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND MEDSHINE DISCOVERY INC (CN) 2023-07-19 — — EP disclosed
CN-113563399-B Method for preparing tiacumicin B iodide and other aromatic iodination products and application thereof 中国科学院南海海洋研究所 2023-06-27 — — CN disclosed
US-20230176481-A1 FILM-FORMING COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2023-06-08 — — US disclosed
US-7919154-B2 1-(trifluoromethyl)naphthalene derivative DIC CORPORATION (JP) 2011-04-05 — — US disclosed
US-20100140547-A1 1-(TRIFLUOROMETHYL)NAPHTHALENE DERIVATIVE DIC CORPORATION (JP) 2010-06-10 — — US disclosed
US-20080275253-A1 halogenation with a halogen donor selected from N-bromosuccinimide, N-iodosuccinimide, N-chlorosuccinimide and N-fluorobenzene-sulfonimide, 1,3-dibromo-5,5-dimethyl imidazolidine-2,4-dione in presence of ZrCl4; bromination of tetramethylsilane JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-11-06 — — US disclosed
US-20080275253-A1 halogenation with a halogen donor selected from N-bromosuccinimide, N-iodosuccinimide, N-chlorosuccinimide and N-fluorobenzene-sulfonimide, 1,3-dibromo-5,5-dimethyl imidazolidine-2,4-dione in presence of ZrCl4; bromination of tetramethylsilane JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-11-06 — — US disclosed
EP-0443533-A2 Positive photoresist composition FUJI PHOTO FILM CO., LTD. (JP) 1991-08-28 — — EP disclosed
US-4374262-A Preparation of hydroxy aromatic carboxylic acids and ester derivatives thereof CELANESE CORPORATION (US) 1983-02-15 — — US disclosed
EP-0049616-A1 Preparation of hydroxy aromatic carboxylic acids and ester derivatives thereof CELANESE CORPORATION (US) 1982-04-14 — — EP disclosed
US-4111962-A Certain substituted 2-phenylnaphtho[1,2-b]furane and -[2,1-b]furane STERLING DRUG INC. (US) 1978-09-05 — — US disclosed
US-3994968-A 2-(5'-Halo-6'-methoxynaphth-2'-yl)-acrylic acid SYNTEX CORPORATION (PM) 1976-11-30 — — US disclosed
US-3960957-A 2-(6'-methoxynaphth-2'yl) propionaldoxime and 5'-halo derivatives thereof SYNTEX CORPORATION (PM) 1976-06-01 — — 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 (3 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-20100140547-A1 1-(TRIFLUOROMETHYL)NAPHTHALENE DERIVATIVE HVCN1, VIM, NES PTPN22 1662/4885POLB 2640/4885HSD17B10 1350/4885
US-20080275253-A1 halogenation with a halogen donor selected from N-bromosuccinimide, N-iodosuccinimide, N-chlorosuccinimide and N-fluorobenzene-sulfonimide, 1,3-dibromo-5,5-dimethyl imidazolidine-2,4-dione in presence of ZrCl4; bromination of tetramethylsilane HDHD5, ZRANB2, CLIC4 PTPN22 3622/4885POLB 3359/4885HSD17B10 2996/4885
US-20240025872-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1B1, CYP1A1 PTPN22 4546/4885POLB 3272/4885HSD17B10 1018/4885

“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.

Send feedback