SCHEMBL568779

SCHEMBL568779

c1ccc2c(c1)CCCCc1ccccc1-2

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.71
MAOA P21397 2/20 0.61
CYP2A6 P11509 1/20 0.61
MAOB P27338 1/20 0.61
HPGD P15428 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
CES1 P23141 1/20 0.55
NOS3 P29474 2/20 0.52
DRD4 P21917 1/20 0.45
NOS2 P35228 1/20 0.44
PDPK1 O15530 1/20 0.44
PARP1 P09874 1/20 0.44
PARP10 Q53GL7 1/20 0.44
PARP11 Q9NR21 1/20 0.44
CYP19A1 P11511 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
MAPT P10636 1/20 0.44
MIF P14174 1/20 0.44
SRD5A1 P18405 1/20 0.43

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
SCHEMBL31430380 1.00 TSHR (0.71) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL30668198 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL30436120 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL31135519 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL31621255 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL30731351 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL29593589 0.97 TSHR (0.67) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL30505637 0.94 CYP2A6 (0.68) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL3103992 0.94 CYP2A6 (0.68) TSHRMAOACYP2A6MAOBHPGD
SCHEMBL30436320 0.91 CYP2A6 (0.65) TSHRMAOACYP2A6MAOBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119688896-B Cell membrane bionic nano-recognition material and preparation method and application thereof 陕西科技大学 2026-05-12 CN claimed
CN-119033823-B Probiotic product and preparation method and application thereof 南昌大学 2025-04-22 CN claimed
CN-119688896-A Cell membrane bionic nano-recognition material and preparation method and application thereof 陕西科技大学 2025-03-25 CN claimed
CN-119033823-A Probiotic product and preparation method and application thereof 南昌大学 2024-11-29 CN claimed
CN-118759172-A Preparation method of allophycocyanin immunofluorescence probe 宝天生物科技(上海)有限公司 2024-10-11 CN claimed
US-20240327322-A1 Crosslinked Polymers with Tunable Coefficients of Thermal Expansion NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC 2024-10-03 US claimed
CN-117327262-B Responsive nano-drug carrier and preparation and application thereof 中山大学附属第三医院 2024-06-14 CN claimed
CN-117946419-A Long-acting antibacterial carboxymethyl chitosan gel and preparation method and application thereof 暨南大学 2024-04-30 CN claimed
US-20240096839-A1 SEMICONDUCTOR PACKAGE SAMSUNG ELECTRONICS CO. LTD. (KR) 2024-03-21 US claimed
CN-114507335-B High-performance epoxy resin with adjustable thermal expansion coefficient and preparation method thereof 复旦大学 2024-03-08 CN claimed
US-20180315988-A1 NEGATIVE THERMAL EXPANSION CURRENT INTERRUPTER AMERICAN LITHIUM ENERGY CORPORATION 2018-11-01 US claimed
WO-2007005760-A1 METHODS OF APPLICATION OF CHEMICAL COMPOUNDS HAVING THERAPEUTIC ACTIVITIES IN TREATING CANCERS WANG HAIBIN (US) 2007-01-11 WO claimed
US-20050282910-A1 Methods of application of chemical compounds having therapeutic activities in treating cancers NINGBO INNOPHARMA TECHNOLOGIES, INC. (CN) 2005-12-22 US claimed
EP-0828764-B1 ADDITION POLYMERS OF POLYCYCLOOLEFINS CONTAINING FUNCTIONAL SUBSTITUENTS GOODRICH CO B F (US) 2000-09-06 EP claimed
US-5484595-A Process for preparation of dibenzocyclooctadiene type lignan TSUMURA & CO. (JP) 1996-01-16 US claimed
EP-0606344-B1 SOLID-FORM ADDITIVE SYSTEMS DISPERSIBLE IN AQUEOUS MEDIA AND METHOD FOR THEIR PREPARATION EASTMAN CHEM CO (US) 1996-01-03 EP claimed
EP-0389631-A1 PROCESS FOR PREPARING DIBENZOCYCLOOCTADIENE TYPE LIGNAN TSUMURA & CO. (JP) 1990-10-03 EP claimed
EP-0259417-B1 RUTHENIUM CATALYST FOR BIARYLIC COUPLING; NEW STEGANOLIDES UNIVERSITE DU MAINE (LE MANS) (FR) 1990-01-03 EP claimed
EP-0259417-A1 RUTHENIUM CATALYST FOR BIARYLIC COUPLING; NEW STEGANOLIDES. UNIV MAINE LE MANS (FR) 1988-03-16 EP claimed
WO-1987005289-A1 RUTHENIUM CATALYST FOR BIARYLIC COUPLING; NEW STEGANOLIDES UNIVERSITE DU MAINE (LE MANS) (FR) 1987-09-11 WO 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 (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-20050282910-A1 Methods of application of chemical compounds having therapeutic activities in treating cancers ABCC1, ABCB1, ABCC2 TSHR 3898/4885MAOA 2909/4885CYP2A6 1068/4885

“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.