SCHEMBL1133458

SCHEMBL1133458

Cc1cc(C)c(-c2ccccc2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2A6 P11509 1/20 0.44
LMNA P02545 3/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
ACHE P22303 1/20 0.43
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
CHEK1 O14757 1/20 0.40
AKT2 P31751 1/20 0.40
BRD4 O60885 1/20 0.40
BRD2 P25440 1/20 0.40
ESR2 Q92731 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
Hydrogen Sulfide SCHEMBL21381346 0.97 PSMB5 (0.44) PSMB5CYP1A2CYP2A6LMNATSHR
Lithium SCHEMBL30636805 0.97 PSMB5 (0.44) PSMB5CYP1A2CYP2A6LMNATSHR
SCHEMBL17180546 0.95 PSMB5 (0.47) PSMB5CYP1A2CYP2A6LMNATSHR
Formaldehyde SCHEMBL28364018 0.93 LMNA (0.42) PSMB5CYP1A2CYP2A6LMNAMAPT
SCHEMBL13037434 0.89 MEN1 (0.41) PSMB5CYP1A2CYP2A6TSHRMAPT
SCHEMBL18569493 0.88 PSMB5 (0.46) PSMB5CYP1A2CYP2A6LMNATSHR
SCHEMBL20873646 0.86 MAPT (0.43) CYP2A6LMNATSHRALOX12ACHE
SCHEMBL30522730 0.84 CNR1 (0.44) PSMB5TSHRACHEMAPTHTT
SCHEMBL4277100 0.84 CNR1 (0.44) PSMB5TSHRACHEMAPTHTT
SCHEMBL16219594 0.84 HTR7 (0.41) PSMB5CYP1A2CYP2A6ACHEBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036555-A Trans-6, 7-disubstituted bicyclo [3.1.1] heptane and preparation method thereof 山东大学 2026-05-15 CN claimed
EP-4561969-A1 FLEXIBLE BENZENE PRODUCTION VIA SELECTIVE-HIGHER-OLEFIN OLIGOMERIZATION OF ETHYLENE Chevron Phillips Chemical Company LP (US) 2025-06-04 EP claimed
CN-119630624-A Flexible benzene production via selective higher olefin oligomerization of ethylene 切弗朗菲利浦化学公司 2025-03-14 CN claimed
CN-117964465-A Method for synthesizing aryl ketone building block by disassembling under promotion of visible light 长江师范学院 2024-05-03 CN claimed
WO-2024025988-A1 FLEXIBLE BENZENE PRODUCTION VIA SELECTIVE-HIGHER-OLEFIN OLIGOMERIZATION OF ETHYLENE CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2024-02-01 WO claimed
CN-115926198-A Injectable tissue regeneration type filler and preparation method thereof 四川大学 2023-04-07 CN claimed
CN-115894964-A Photo-curing porous hydrogel cell preparation and preparation method thereof 四川大学 2023-04-04 CN claimed
CN-115245589-A Novel degradable embolism microsphere with controllable particle size and preparation method thereof 苏州浩微生物医疗科技有限公司 2022-10-28 CN claimed
CN-110003506-A A kind of preparation method of high intensity Injectable micelle cross-linked polysaccharides hydrogel 西安理工大学 2019-07-12 CN claimed
CN-109913022-A A kind of UV white putty of high rigidity 惠州市长润发涂料有限公司 2019-06-21 CN claimed
US-20090203745-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF INTEGRINS AND USE THEREOF JERINI AG (DE) 2009-08-13 US claimed
CN-122036555-A Trans-6, 7-disubstituted bicyclo [3.1.1] heptane and preparation method thereof 山东大学 2026-05-15 CN disclosed
US-20260130872-A1 Substituted Bicyclic Compounds, Compositions and Methods of Use DEEP APPLE THERAPEUTICS, INC. (US) 2026-05-14 US disclosed
US-12610730-B2 Metal complex and light emitting device CITY UNIVERSITY OF HONG KONG (HK) 2026-04-21 US disclosed
US-12435016-B2 Flexible benzene production via selective-higher-olefin oligomerization of ethylene CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2025-10-07 US disclosed
US-5561016-A HAVING PHOTOCONDUCTIVE LAYER CONTAINING CHARGE GENERATING MATERIAL, POLYVINYL BUTYRAL BINDER, CHARGE TRANSPORTING MATERIAL AND BIPHENYL(OR DERIVATIVE) ON ELECTROCONDUCTIVE SUPPORT RICOH COMPANY, LTD. (JP) 1996-10-01 US disclosed
US-4870048-A COLORFAST IMAGE, LIGHT RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1989-09-26 US disclosed
US-4631204-A DISSOLVING METAL SALT OF CARBOXYLIC ACID IN DIPHENYL ALKANE DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1986-12-23 US disclosed
US-4559242-A FOR PRESSURE SENSITIVE RECORDING, TWO COATING SOLUTIONS CONTAININGAROMATIC CARBOXYLIC ACID METAL SALT FUJI PHOTO FILM CO., LTD. (JP) 1985-12-17 US disclosed
US-4024170-A Liquid clathrates THE UNIVERSITY OF ALABAMA (US) 1977-05-17 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-20260130872-A1 Substituted Bicyclic Compounds, Compositions and Methods of Use GIPR, GLP1R, SIGMAR1 PSMB5 2369/4885CYP1A2 2495/4885CYP2A6 383/4885
US-20090203745-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF INTEGRINS AND USE THEREOF ITGB1, ITGA2, ITGB2 PSMB5 223/4885CYP1A2 1728/4885CYP2A6 2089/4885
US-12610730-B2 Metal complex and light emitting device OPRD1, OCIAD2, ORC3 PSMB5 2541/4885CYP1A2 2696/4885CYP2A6 2859/4885

“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.