SCHEMBL556980

SCHEMBL556980

[Ni].c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 0.33
KCNA3 P22001 1/20 0.31
CALM1 P0DP23 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GAA P10253 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
SCHEMBL954340 1.00 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
Hydrochloric Acid SCHEMBL3404434 0.97 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2
Hydrochloric Acid SCHEMBL6326 0.97 CYP3A4 (0.41) CYP3A4TDP1ESR1ESR2
SCHEMBL35092 0.97 CYP3A4 (0.45) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL22749145 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL7934432 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL4255002 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL22749132 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL31379074 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3
SCHEMBL30486913 0.94 CYP3A4 (0.43) CYP3A4TDP1ESR1ESR2KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158193-B1 METHOD FOR THE PRODUCTION OF ALKYL-SUBSTITUTED THIOPHENES SALTIGO GMBH (DE) 2012-08-08 EP claimed
EP-1541575-B1 NOVEL PROCESS FOR PRODUCING IMIDAZO(1,2-B)PYRIDAZINE DERIVATIVE SUMITOMO CHEMICAL CO (JP) 2010-03-03 EP claimed
EP-1836233-A1 HALOGENATED THIOPHENE MONOMER FOR THE PREPARATION OF REGIOREGULAR POLYTHIOPHENES Honeywell International Inc. (US) 2007-09-26 EP claimed
WO-2006076156-A1 HALOGENATED THIOPHENE MONOMER FOR THE PREPARATION OF REGIOREGULAR POLYTHIOPHENES HONEYWELL INTERNATIONAL INC. (US) 2006-07-20 WO claimed
CN-117924173-B Aniline quaternary ammonium salt chiral phase transfer catalyst and application thereof in asymmetric alkylation catalysis of amino acid derivatives 广东工业大学 2024-07-09 CN disclosed
CN-114008494-B Optical filter, imaging device and optical sensor AGC株式会社 2024-06-28 CN disclosed
CN-112469707-B Preventive or therapeutic agent for spinal muscular atrophy 利伯纳生物科学株式会社 2024-06-21 CN disclosed
CN-118043308-A Bond formation method based on coupling reaction 中外制药株式会社 2024-05-14 CN disclosed
CN-118005619-A Process for producing heterocyclic compound 武田药品工业株式会社 2024-05-10 CN disclosed
CN-117924173-A Aniline quaternary ammonium salt chiral phase transfer catalyst and application thereof in asymmetric alkylation catalysis of amino acid derivatives 广东工业大学 2024-04-26 CN disclosed
CN-111499500-B Polymerizable monomer, polymer compound for conductive polymer, and process for producing the same 信越化学工业株式会社 2024-04-23 CN disclosed
CN-113453764-B 7H-pyrrolo [2,3-d ] pyrimidin-4-amine derivatives 大鹏药品工业株式会社 2024-04-16 CN disclosed
US-5308607-A FOR USE IN DIAGNOSTIC RADIOLOGY STERLING WINTHROP INC. (US) 1994-05-03 US disclosed
EP-0561175-A1 Pyrimidine derivatives and pharmaceutical compostions containing them MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1993-09-22 EP disclosed
US-5162473-A NEUTRAL AND ELECTRICALLY CONDUCTIVE POLY(HETEROCYCLIC VINYLENES) AND PROCESSES FOR PREPARING SAME ALLIED-SIGNAL (US) 1992-11-10 US disclosed
US-5159040-A Neutral and electrically conductive poly(heterocyclic vinylenes) and processes for preparing same ALLIED-SIGNAL INC. (US) 1992-10-27 US disclosed
US-5139703-A Neutral and electrically conductive poly(heterocyclic vinylenes) and processes for preparing same ALLIED-SIGNAL INC. (US) 1992-08-18 US disclosed
US-5068060-A Neutral and electrically conductive poly(heterocyclic vinylenes) and processes for preparing same ALLIED-SIGNAL INC. (US) 1991-11-26 US disclosed
EP-0318518-A1 NEUTRAL AND ELECTRICALLY CONDUCTIVE POLY(HETEROCYCLIC VINYLENES) AND PROCESSES FOR PREPARING SAME ALLIED CORPORATION (US) 1989-06-07 EP disclosed
WO-1988000954-A1 NEUTRAL AND ELECTRICALLY CONDUCTIVE POLY(HETEROCYCLIC VINYLENES) AND PROCESSES FOR PREPARING SAME ALLIED CORPORATION (US) 1988-02-11 WO disclosed