SCHEMBL2202295

SCHEMBL2202295

CC(C)c1cccc(C(C)C)c1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 5/20 0.55
GABRB2 P47870 3/20 0.55
GABRG2 P18507 2/20 0.55
GABRB3 P28472 2/20 0.55
GABRB1 P18505 2/20 0.55
LMNA P02545 2/20 0.55
FAAH O00519 2/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
PTGS1 P23219 1/20 0.55
SLC6A2 P23975 1/20 0.55
HTR2C P28335 1/20 0.55
GABRA5 P31644 1/20 0.55
GABRA3 P34903 1/20 0.55
HTR2B P41595 1/20 0.55
GABRA2 P47869 1/20 0.55

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
SCHEMBL16953290 0.88 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL29661785 0.87 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL6679470 0.87 GABRA1 (0.48) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL29515496 0.85 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL61794 0.85 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL9080666 0.84 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL11120667 0.83 GABRA1 (0.44) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL22791943 0.83 CYP1A2 (0.47) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL3604233 0.83 GABRA1 (0.60) GABRA1GABRB2GABRG2GABRB3GABRB1
SCHEMBL31634517 0.83 GABRA1 (0.60) GABRA1GABRB2GABRG2GABRB3GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260028482-A1 Substitution at the Central Position of Heptamethine Dyes By Aryllithium Addition for Improved Fluorophores UNIV ARKANSAS (US) 2026-01-29 US claimed
CN-119219455-A Aromatic ring hydrogen-deuterium exchange reaction catalytic system and preparation method of deuterated aromatic hydrocarbon 国科大杭州高等研究院 2024-12-31 CN claimed
CN-113788859-B Large-steric-hindrance N-heterocyclic carbene-palladium complex, preparation method and application thereof, and synthetic method of sonchibu based on complex 中山大学 2023-03-31 CN claimed
CN-113788859-A Large-steric-hindrance N-heterocyclic carbene-palladium complex, preparation method and application thereof, and synthetic method of sonchibu based on complex 中山大学 2021-12-14 CN claimed
CN-112209972-A Large-steric-hindrance N-heterocyclic carbene-palladium complex, preparation method and application thereof, and synthetic method of sonchibu based on complex 中山大学 2021-01-12 CN claimed
CN-106892945-A A kind of N-heterocyclic carbine-palladium complex, its preparation method and application 温州大学 2017-06-27 CN claimed
US-20260028482-A1 Substitution at the Central Position of Heptamethine Dyes By Aryllithium Addition for Improved Fluorophores UNIV ARKANSAS (US) 2026-01-29 US disclosed
WO-2025261907-A1 NONLINEAR OPTICAL DYES WITH IMPROVED STABILITY SILORIX GMBH (DE) 2025-12-26 WO disclosed
EP-4667535-A1 NONLINEAR OPTICAL DYES WITH IMPROVED STABILITY SilOriX GmbH (DE) 2025-12-24 EP disclosed
US-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2025-12-18 US disclosed
US-12473383-B2 Transition metal catalysts for olefin polymerization DOW GLOBAL TECHNOLOGIES LLC (US) 2025-11-18 US disclosed
US-12440491-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2025-10-14 US disclosed
US-20250313662-A1 IRON-CATALYZED METATHESIS POLYMERIZATION OF OLEFINS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2025-10-09 US disclosed
EP-0797575-B1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE HOFFMANN LA ROCHE (CH) 2003-10-15 EP disclosed
US-6017905-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 2000-01-25 US disclosed
US-5959113-A REACTING A DIKETONE DERIVATIVE WITH AN ALDEHYDE DERIVATIVE; ADMINISTERING TO TREAT ATHEROSCLEROSIS, PSORIASIS, ALOPECIA AND TUMORS HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
US-5807846-A TREATING HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1998-09-15 US disclosed
EP-0797575-A1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE F. HOFFMANN-LA ROCHE AG (CH) 1997-10-01 EP disclosed
WO-1996018626-A1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE F. HOFFMANN-LA ROCHE AG (CH) 1996-06-20 WO disclosed
US-3962307-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 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 (5 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-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS GABRA1 4420/4885GABRB2 4475/4885GABRG2 2943/4885
US-20250313662-A1 IRON-CATALYZED METATHESIS POLYMERIZATION OF OLEFINS PPOX, HMOX1, HMOX2 GABRA1 4480/4885GABRB2 4349/4885GABRG2 4641/4885
US-12440491-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS GABRA1 4420/4885GABRB2 4475/4885GABRG2 2943/4885
US-12473383-B2 Transition metal catalysts for olefin polymerization SOD1, PPOX, HMOX1 GABRA1 4308/4885GABRB2 3902/4885GABRG2 3783/4885
US-20260028482-A1 Substitution at the Central Position of Heptamethine Dyes By Aryllithium Addition for Improved Fluorophores KCNK5, KCNA7, KCNA4 GABRA1 1607/4885GABRB2 1007/4885GABRG2 2750/4885

“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.