SCHEMBL621971

SCHEMBL621971

C=CCc1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.54
CYP2A6 P11509 1/20 0.54
XDH P47989 1/20 0.50
ALDH1A1 P00352 3/20 0.48
PPARG P37231 2/20 0.48
PPARD Q03181 2/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH2 P05091 1/20 0.48
GAA P10253 1/20 0.48
GABRA1 P14867 1/20 0.48
AKR1B1 P15121 1/20 0.48
HPGD P15428 1/20 0.48
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
GABRB2 P47870 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PPARA Q07869 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
SCHEMBL31195248 1.00 CYP1A2 (0.54) CYP1A2CYP2A6XDHALDH1A1PPARG
Bromide SCHEMBL28224561 0.98 CYP1A2 (0.52) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL1116335 0.94 XDH (0.48) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL4563164 0.94 XDH (0.48) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL3259762 0.91 XDH (0.58) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL7555913 0.89 XDH (0.56) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL253471 0.86 XDH (0.54) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL7043823 0.86 XDH (0.54) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL11494827 0.86 XDH (0.54) CYP1A2CYP2A6XDHALDH1A1PPARG
SCHEMBL198193 0.86 XDH (0.54) CYP1A2CYP2A6XDHALDH1A1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688967-A1 AQUEOUS COMPOSITION Nouryon Chemicals International B.V. (NL) 2026-02-11 EP claimed
US-20260003210-A1 DIFFRACTIVE CONTACT LENSES ALCON INC (CH) 2026-01-01 US claimed
US-12379611-B2 Diffractive contact lenses ALCON INC. (CH) 2025-08-05 US claimed
WO-2024200582-A1 AQUEOUS COMPOSITION NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2024-10-03 WO claimed
CN-118255603-A Preparation method of graphene modified brake disc 浙江万赛汽车零部件股份有限公司 2024-06-28 CN claimed
EP-4356169-A1 MULTIFOCAL DIFFRACTIVE SILICONE HYDROGEL CONTACT LENSES Alcon Inc. (CH) 2024-04-24 EP claimed
US-20240065949-A1 ALKALI-SWELLABLE MULTI-FUNCTIONAL RHEOLOGY MODIFIERS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2024-02-29 US claimed
CN-117280252-A Multifocal diffractive silicone hydrogel contact lenses 爱尔康公司 2023-12-22 CN claimed
US-11833233-B2 Alkali-swellable multi-functional rheology modifiers NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2023-12-05 US claimed
EP-3440120-B1 PROCESS AND HYDROCARBON SOLUBLE SALINE HYDRIDE CATALYST FOR HYDROGEN MEDIATED SALINE HYDRIDE INIATED ANIONIC CHAIN TRANSFER POLYMERIZATION AND POLYMER DISTRIBUTION COMPOSITIONS PRODUCED THEREFROM ALBEMARLE CORP (US) 2023-11-29 EP claimed
CN-1817843-A Production of 2-alkyl-6-acyl-naphthaline HUADONG SCIENCE AND TECHNOLOGY (CN) 2006-08-16 CN claimed
EP-0929501-B1 ALKYLATION AND ACYLATION REACTIONS SWAN THOMAS & CO LTD (GB) 2003-07-30 EP claimed
US-6504070-B2 Using catalyst comprising iridium compound and ligand to selectively position alkyl chain on aromatic ring NIPPON MITSUBISHI OIL CORPORATION (JP) 2003-01-07 US claimed
US-20020052535-A1 Method of alkylating aromatic hydrocarbon NIPPON MITSUBISHI OIL CORPORATION (JP) 2002-05-02 US claimed
US-6197226-B1 COMPRISING DIPPING RESIN INTO A LIQUID CONTAINING POLAR COMPOUND SELECTED FROM POLAR INORGANIC COMPOUNDS AND POLAR ORGANIC COMPOUNDS AND TINTING RESIN, WHEREIN RESIN IS OBTAINED BY CURING BY POLYMERIZATION A SULFUR CONTAINING COMPOUND MITSUBISHI GAS CHEMICAL COMPANY (JP) 2001-03-06 US claimed
US-5516954-A CATALYST OF GROUP IVB METAL OXIDE MODIFIED WITH OXYANION OF GROUP VIB METAL MOBIL OIL CORPORATION (US) 1996-05-14 US claimed
EP-0494315-A1 PROCESS FOR PRODUCING 2-ALKYL-6-ETHYL-NAPHTHALENE NIPPON STEEL CHEMICAL CO., LTD. (JP) 1992-07-15 EP claimed
US-5001295-A Process for preparing dialkylnaphthalene MOBIL OIL CORP. (US) 1991-03-19 US claimed
EP-0280055-B1 PROCESS FOR THE PREPARATION OF 2,6-DIALKYL NAPHTHALINE RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1990-09-26 EP claimed
US-4795847-A CATALYTIC OXIDATION OF NAPHTHALENE USING ZEOLITE RUTGERSWERKE AKTIENGESELLSCHAFT (DE) 1989-01-03 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20240065949-A1 ALKALI-SWELLABLE MULTI-FUNCTIONAL RHEOLOGY MODIFIERS PUF60, CUTA, SMURF1 CYP1A2 4597/4885CYP2A6 4382/4885XDH 4567/4885
US-20020052535-A1 Method of alkylating aromatic hydrocarbon AHR, ALKBH3, ALKBH2 CYP1A2 286/4885CYP2A6 120/4885XDH 2613/4885
US-20260003210-A1 DIFFRACTIVE CONTACT LENSES LBR, CRYZ, CRYAA CYP1A2 4388/4885CYP2A6 4042/4885XDH 2961/4885
US-11833233-B2 Alkali-swellable multi-functional rheology modifiers PUF60, CUTA, SMURF1 CYP1A2 4597/4885CYP2A6 4382/4885XDH 4567/4885

“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.