SCHEMBL164361

SCHEMBL164361

Cc1ccccc1C(C)(C)N

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
ACHE P22303 2/20 0.45
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
CASR P41180 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
CYP3A4 P08684 1/20 0.40
ALDH1A1 P00352 3/20 0.37
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
SLC6A2 P23975 1/20 0.36
CYP1A2 P05177 2/20 0.33
CYP2A6 P11509 2/20 0.33
CD44 P16070 1/20 0.33
TRPA1 O75762 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL29581427 1.00 TSHR (0.45) TSHRACHEGABRA1GABRB2CASR
Fluoride SCHEMBL1502827 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Iodide SCHEMBL1502892 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Bromide SCHEMBL622796 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Hydrochloric Acid SCHEMBL136350 0.97 TDP1 (0.44) TSHRACHEGABRA1GABRB2CASR
Hydrochloric Acid SCHEMBL23886258 0.97 TDP1 (0.44) TSHRACHEGABRA1GABRB2CASR
Water SCHEMBL93584 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Ammonia Solution, Strong SCHEMBL5145133 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Bromide SCHEMBL21460045 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Hydrogen Sulfide SCHEMBL17421753 0.97 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR

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

Appears in 3882 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025102202-A1 POLYISOCYANATE COMPOSITION, AND COATING LAYER HAVING IMPROVED CHEMICAL RESISTANCE 万华化学集团股份有限公司 2025-05-22 WO claimed
CN-119998234-A Enhanced hydrothermal stability of zeolites for selective catalytic reduction applications 巴斯夫移动排放催化剂有限公司 2025-05-13 CN claimed
CN-119978314-A Polyisocyanate composition and coating with improved chemical resistance 万华化学集团股份有限公司 2025-05-13 CN claimed
US-20250113829-A1 HIGH MOLECULAR WEIGHT MODIFIED RNA COMPOSITIONS nanoSUR LLC 2025-04-10 US claimed
CN-119708410-A Vibration-damping noise-reducing polyurethane elastic material and manufacturing method thereof 东莞市亚马电子有限公司 2025-03-28 CN claimed
US-12090447-B2 Doped membranes GAMBRO LUNDIA AB (SE) 2024-09-17 US claimed
CN-118613517-A Preparation and use of polyisocyanates containing iminooxadiazinedione groups 巴斯夫欧洲公司 2024-09-06 CN claimed
WO-2024165361-A1 PREPARATION OF POLYISOCYANATES CONTAINING IMINOOXADIAZINEDIONE GROUPS AND THEIR USE BASF SE (DE) 2024-08-15 WO claimed
US-20240175005-A1 PURIFICATION AND RECYCLING OF mRNA NUCLEOTIDE CAPS ARES CAPITAL CORPORATION, AS AGENT 2024-05-30 US claimed
CN-117924683-A Polycarbonate resin and preparation method and application thereof 万华化学集团股份有限公司 2024-04-26 CN claimed
EP-0079030-B1 CONTACT LENS REJUVENATING SOLUTION SYNTEX (U.S.A.) INC. (US) 1986-04-09 EP claimed
EP-0024628-B1 PREPARATION OF ETHYLENE CARBONATE THE DOW CHEMICAL COMPANY (US) 1985-04-03 EP claimed
US-4388229-A REMOVING OCCLUDED AND ADSORBED CHEMICALS SYNTEX (U.S.A.) INC. (US) 1983-06-14 US claimed
EP-0079030-A1 Contact lens rejuvenating solution SYNTEX (U.S.A.) INC. (US) 1983-05-18 EP claimed
EP-0032245-B1 PROCESS FOR THE PREPARATION OF AROMATIC CHLOROFORMATES BASF Aktiengesellschaft (DE) 1983-04-13 EP claimed
EP-0016432-B1 PROCESS FOR PREPARING 1-AMINO-2-PHENOXY-4-HYDROXY-ANTHRAQUINONE BASF Aktiengesellschaft (DE) 1981-11-25 EP claimed
US-4278606-A ETHERIFICATION WITH PHENOL BASF AKTIENGESELLSCHAFT (DE) 1981-07-14 US claimed
EP-0016432-A1 Process for preparing 1-amino-2-phenoxy-4-hydroxy-anthraquinone BASF Aktiengesellschaft (DE) 1980-10-01 EP claimed
US-4119518-A Electrolytic cell for treatment of water MILLER JORGE 1978-10-10 US claimed
US-4006032-A Process for removing off-flavor from maple sirup THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1977-02-01 US claimed