SCHEMBL21065765

SCHEMBL21065765

CCCCNCC.[LiH]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL36957 0.97
Iodide SCHEMBL27224391 0.93
SCHEMBL11106382 0.93 TSHR (0.93)
Hydrochloric Acid SCHEMBL22771964 0.93
Bromide SCHEMBL27224390 0.93
Ammonia Solution, Strong SCHEMBL4387461 0.93
Water SCHEMBL27224392 0.93
SCHEMBL20922334 0.90 TSHR (0.88)
SCHEMBL4166725 0.90 TSHR (0.88)
SCHEMBL10045106 0.90 TSHR (0.88)

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119403841-A Conjugated diene polymer, rubber composition, and tire member 旭化成株式会社 2025-02-07 CN disclosed
CN-118715249-A Conjugated diene polymer, conjugated diene polymer composition, and conjugated diene polymer crosslinked product 旭化成株式会社 2024-09-27 CN disclosed
CN-112979876-B Branched conjugated diene polymer and method for producing same, method for producing rubber composition, and method for producing tire 旭化成株式会社 2023-09-08 CN disclosed
CN-116635247-A Rubbery polymer, process for producing rubbery polymer, rubber composition, and tread for tire 旭化成株式会社 2023-08-22 CN disclosed
US-11091609-B2 Modified conjugated diene-based polymer, production method thereof, rubber composition and tire ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-08-17 US disclosed
EP-3502144-B1 MODIFIED CONJUGATED DIENE-BASED POLYMER, PRODUCTION METHOD THEREOF, RUBBER COMPOSITION AND TIRE ASAHI CHEMICAL IND (JP) 2021-06-02 EP disclosed
US-20190203021-A1 Modified Conjugated Diene-Based Polymer, Production Method Thereof, Rubber Composition and Tire ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-07-04 US disclosed
EP-3502144-A1 MODIFIED CONJUGATED DIENE POLYMER, METHOD FOR PRODUCING SAME, RUBBER COMPOSITION, AND TIRE ASAHI KASEI KABUSHIKI KAISHA (JP) 2019-06-26 EP disclosed
CN-104379658-B Rubber composition for tire tread 株式会社普利司通 2016-10-19 CN disclosed
CN-1304433-C Process for producing modified polymer, modified polymer obtained by the process, and rubber composition BRIDGESTONE CORP (JP) 2007-03-14 CN disclosed
CN-1646576-A Process for producing modified polymer, modified polymer obtained by the process, and rubber composition BRIDGESTONE CORP (JP) 2005-07-27 CN disclosed