SCHEMBL4991372

SCHEMBL4991372

B.CC(C)(C)CP

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
SCHEMBL4375030 0.95
SCHEMBL29666334 0.90
Iodide SCHEMBL6703307 0.90
Hydrochloric Acid SCHEMBL4169129 0.90
Methyl Alcohol SCHEMBL28045618 0.86
SCHEMBL10396611 0.70
SCHEMBL2616763 0.70
SCHEMBL20008725 0.70
SCHEMBL7126052 0.68
SCHEMBL290170 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110997686-B Method for producing 2, 3-biphosphinylpyrazine derivative and method for producing phosphine transition metal complex 日本化学工业株式会社 2023-11-03 CN disclosed
US-11773120-B2 Method for producing optically active 2, 3-bisphosphinopyrazine derivative and method for producing optically active phosphine transition metal complex NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2023-10-03 US disclosed
CN-111655708-B 2, 3-biphosphinopyrazine derivative, process for producing the same, complex compound, catalyst, and process for producing organoboron compound 日本化学工业株式会社 2023-08-25 CN disclosed
US-11084835-B2 2,3-bisphosphinopyrazine derivative, method for producing same, transition metal complex, asymmetric catalyst, and method for producing organic boron compound NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2021-08-10 US disclosed
US-11021500-B2 Process for preparing optically active 2,3-bisphosphino-substituted quinoxalines NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2021-06-01 US disclosed
US-20210047351-A1 2,3-BISPHOSPHINOPYRAZINE DERIVATIVE, METHOD FOR PRODUCING SAME, TRANSITION METAL COMPLEX, ASYMMETRIC CATALYST, AND METHOD FOR PRODUCING ORGANIC BORON COMPOUND NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2021-02-18 US disclosed
US-20200247833-A1 METHOD FOR PRODUCING 2,3-BISPHOSPHINOPYRAZINE DERIVATIVE, AND METHOD FOR PRODUCING PHOSPHINE TRANSITION METAL COMPLEX NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2020-08-06 US disclosed
US-20200087330-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 2, 3-BISPHOSPHINOPYRAZINE DERIVATIVE AND METHOD FOR PRODUCING OPTICALLY ACTIVE PHOSPHINE TRANSITION METAL COMPLEX NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2020-03-19 US disclosed
WO-2019172150-A1 2,3-BISPHOSPHINOPYRAZINE DERIVATIVE, METHOD FOR PRODUCING SAME, TRANSITION METAL COMPLEX, ASYMMETRIC CATALYST, AND METHOD FOR PRODUCING ORGANIC BORON COMPOUND 日本化学工業株式会社 2019-09-12 WO disclosed
US-10111892-B2 Anti-cancer agent NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2018-10-30 US disclosed
US-20120252762-A1 ANTI-CANCER AGENT NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2012-10-04 US disclosed
EP-2502627-A1 ANTI-CANCER AGENT Nippon Chemical Industrial Co., Ltd. (JP) 2012-09-26 EP disclosed
US-7414156-B2 Non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation WARNER LAMBERT CO. (US) 2008-08-19 US disclosed
US-20050124830-A1 Non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation HOGE GARRETT S II (US) 2005-06-09 US disclosed
US-6855849-B2 Non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation WARNER-LAMBERT COMPANY (US) 2005-02-15 US disclosed
US-20040138487-A1 Bisphospholane ligands with metals for hydrogenation catalysts for enantiomorphs HOGE GARRETT STEWART 2004-07-15 US disclosed
US-6689915-B2 AS CATALYSTS FOR USE IN ASYMMETRIC TRANSFORMATION REACTIONS TO PROVIDE HIGH ENANTIOMERIC EXCESSES OF FORMED COMPOUNDS WARNER-LAMBERT COMPANY LLC 2004-02-10 US disclosed
US-20030073868-A1 Non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation WARNER-LAMBERT COMPANY 2003-04-17 US disclosed
US-20020143214-A1 Synthesis of non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation HOGE GARRETT STEWART (US) 2002-10-03 US disclosed
EP-1243591-A2 Synthesis of non-C2-symmetric bisphosphine ligands as catalysts for asymmetric hydrogenation WARNER-LAMBERT COMPANY (US) 2002-09-25 EP disclosed