SCHEMBL4632003

SCHEMBL4632003

C=CCC1(CC=C)c2ccccc2-c2ccc(I)cc21

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.40
APEX1 P27695 1/20 0.33
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 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
SCHEMBL1929731 0.92 TDP2 (0.33) PGR
Fluorene SCHEMBL28116732 0.90 ALDH1A1 (0.39) PGRADRA1DADRA1AADRA1B
SCHEMBL30511096 0.84 PGR (0.49) PGRAPEX1ADRA1DADRA1AADRA1B
SCHEMBL88451 0.84 PGR (0.49) PGRAPEX1ADRA1DADRA1AADRA1B
SCHEMBL1928517 0.83 PDK2 (0.33)
SCHEMBL1926840 0.81 TGM2 (0.35) PGR
SCHEMBL1809551 0.81 PDK2 (0.46) PGRAPEX1
SCHEMBL14740499 0.78 PGR (0.41) PGRAPEX1
SCHEMBL660283 0.78 PDK2 (0.36) PGRAPEX1
SCHEMBL5140623 0.77 PGR (0.38) PGRAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5125023-A None JP disclosed
JP-6100478-A None JP disclosed
JP-6192188-A None JP disclosed
EP-1520846-B1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORP (JP) 2008-03-05 EP disclosed
US-7138484-B2 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2006-11-21 US disclosed
US-20050075478-A1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2005-04-07 US disclosed
EP-1520846-A1 Method for producing polymerized hydrocarbon JFE Chemical Corporation (JP) 2005-04-06 EP disclosed
JP-2000178237-A PRODUCTION OF 2-BISARYLAMINO-9,9-DIALKYLFLUORENE MITSUI CHEMICALS INC 2000-06-27 JP disclosed
US-6010991-A QUATERIZED ANTI-MICROBIAL OF A FATTY AMINE; ABRASIVE, AN ESSENTIAL OIL, AND THE REMAINDER WATER. STATE INDUSTRIAL PRODUCTS (US) 2000-01-04 US disclosed
JP-H06192188-A PRODUCTION OF 2-N,N-DIARYLAMINO-9,9-DIALKYLFLUORENE COPYER CO LTD 1994-07-12 JP disclosed
JP-H06100478-A PRODUCTION OF 2-IODO-9,9-DIALKYLFLUORENE COPYER CO LTD 1994-04-12 JP disclosed
JP-H05125023-A SEPARATION OF 2-BISARYLAMINO-9,9-DIALKYLFLUORENE MITSUI TOATSU CHEM INC 1993-05-21 JP disclosed