SCHEMBL83433

SCHEMBL83433

CCCCCCCCCCCc1nccn1C(C)C#N

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.36
TLR8 Q9NR97 2/20 0.33
CYP19A1 P11511 6/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
ADA P00813 1/20 0.31
KCNH2 Q12809 1/20 0.30

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
SCHEMBL9231228 1.00 TLR7 (0.36) TLR7TLR8CYP19A1TSHRHSD17B10
SCHEMBL27497320 1.00 TLR7 (0.36) TLR7TLR8CYP19A1TSHRHSD17B10
Hydrochloric Acid SCHEMBL28733891 0.99 TLR7 (0.35) TLR7TLR8CYP19A1TSHRHSD17B10
SCHEMBL10824696 0.98 TLR7 (0.35) TLR7TLR8CYP19A1ALDH1A1POLB
SCHEMBL7165333 0.93 ALDH1A1 (0.40) TLR7TLR8CYP19A1ALDH1A1POLB
SCHEMBL16412168 0.92 TLR7 (0.32) TLR7CYP19A1TSHRHSD17B10
Mellitic Acid SCHEMBL27720793 0.90 AGTR1 (0.35)
SCHEMBL718393 0.88 KCNH2 (0.32) KCNH2
SCHEMBL7649337 0.87 HSD11B1 (0.41) TSHR
Benzoic Acid SCHEMBL28698248 0.86 AGTR1 (0.43) TSHRALDH1A1KMT2A

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 4057 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120005486-A Low dielectric resin composition 南亚塑胶工业股份有限公司 2025-05-16 CN claimed
CN-119505830-A Insulating heat-conducting material, preparation method and application thereof, radiator and power assembly 深圳市汇川技术股份有限公司 2025-02-25 CN claimed
CN-119490771-A Thermosetting insulating adhesive, preparation method and application thereof 杭州福斯特应用材料股份有限公司 2025-02-21 CN claimed
CN-119194858-A Preparation of dipping liquid for fiber surface treatment and green two-bath dipping method 北京化工大学 2024-12-27 CN claimed
CN-111511809-B Curing agent composition and resin composition containing the same 赫克塞尔合成有限公司 2024-08-16 CN claimed
CN-114341424-B Composition for fiber surface treatment and fiber treatment method 北京化工大学 2024-07-23 CN claimed
CN-117988118-A Composition for fiber surface treatment and fiber treatment method 北京化工大学 2024-05-07 CN claimed
CN-117727527-A Magnetic semi-fluid composition and inductor 深圳市优宝新材料科技有限公司 2024-03-19 CN claimed
US-11891545-B2 Composition, low halogen and fast curing conductive adhesive and its preparation method BLUE OCEAN & BLACK STONE TECHNOLOGY CO., LTD.(BEIJING) 2024-02-06 US claimed
EP-2977406-B1 CURABLE COMPOSITION LG CHEMICAL LTD (KR) 2024-01-24 EP claimed
EP-0251760-B1 Rubber composition BRIDGESTONE CORP (JP) 1994-01-26 EP claimed
US-5140055-A Improved high speed grip performance BRIDGESTONE CORPORATION (JP) 1992-08-18 US claimed
US-4966928-A REACTION PRODUCT OF DICYCLOPENTADIENE AND MALEIC ANHYDRIDE, CURE ACCELERATOR, FILLER, IMPACT MODIFIER, SURFACE SMOOTHING AGENT SOMAR CORPORATION (JP) 1990-10-30 US claimed
US-4658009-A Novel 2-substituted-4,6-diamino-s-triazine/isocyanuric acid adduct, process for synthesis of said adduct and process for curing polyepoxy resin with said adduct SHIKOKU CHEMICALS CORPORATION (JP) 1987-04-14 US claimed
US-4575479-A HIGH SPEED; PHOTO-FIXING ABILITY RICOH COMPANY, LTD. (JP) 1986-03-11 US claimed
US-4370467-A CYANATE, PEROXIDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-01-25 US claimed
US-4304818-A POLYISOCYANURATE-OXAZOLIDONES FROM POLYISOCYANATE AND POLYEPOXIDE HITACHI, LTD. (JP) 1981-12-08 US claimed
US-4110364-A AND BISMALEIIMIDES MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1978-08-29 US claimed
US-4026872-A PHENOLIC CURING AGENTS HITACHI, LTD. (JA) 1977-05-31 US claimed
US-3984376-A Thermosetting resin compositions prepared from isocyanates and epoxyphenols HITACHI, LTD. (JA) 1976-10-05 US claimed