SCHEMBL8680264

SCHEMBL8680264

CCCCCC=C1NCCN1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
PRKCA P17252 5/20 0.33
FAAH O00519 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
PPARG P37231 2/20 0.32
TYR P14679 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CCR5 P51681 4/20 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
SCHEMBL11560691 0.98 TSHR (0.39) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL27820083 0.74 TSHR (0.30) TSHRNFKB1NFKB2RELA
SCHEMBL27520703 0.70 CCR5 (0.35) TSHRNFKB1NFKB2RELACCR5
SCHEMBL15618384 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL1797486 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL353470 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL21300 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL14915686 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL15618662 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA
SCHEMBL5606129 0.67 TSHR (0.44) TSHRNFKB1NFKB2RELAPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2732312-B2 1998-03-30 JP claimed
EP-0766553-A1 INTRAOCULAR IRRIGATING SOLUTION CONTAINING AGENT FOR CONTROLLING IOP ALCON LABORATORIES, INC. (US) 1997-04-09 EP claimed
US-5605922-A VISION DISORDERS; SIDE EFFECT REDUCTION ALCON LABORATORIES, INC. (US) 1997-02-25 US claimed
US-5523316-A COMPRISES AN ANTIOXIDANT/FREE RADICAL SCAVENGER, ELECTROLYTES, CELLULAR ENERGY SOURCE, BICARBONATE AND A BUFFER ALCON LABORATORIES, INC. (US) 1996-06-04 US claimed
WO-1996000055-A1 INTRAOCULAR IRRIGATING SOLUTION CONTAINING AGENT FOR CONTROLLING IOP ALCON LABORATORIES, INC. (US) 1996-01-04 WO claimed
EP-0365662-B1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS ALCON LAB INC (US) 1994-03-09 EP claimed
EP-0365662-A4 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS 1990-10-24 EP claimed
EP-0365662-A1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS. ALCON LAB INC (US) 1990-05-02 EP claimed
WO-1989010126-A1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS ALCON LABORATORIES, INC. (US) 1989-11-02 WO claimed
US-5811443-A SIDE EFFECT REDUCTION ALCON LABORATORIES, INC. (US) 1998-09-22 US disclosed
EP-0664707-B1 COMBINATIONS OF PROSTAGLANDINS AND CLONIDINE DERIVATIVES FOR THE TREATMENT OF GLAUCOMA ALCON LAB INC (US) 1997-06-04 EP disclosed
EP-0766553-A1 INTRAOCULAR IRRIGATING SOLUTION CONTAINING AGENT FOR CONTROLLING IOP ALCON LABORATORIES, INC. (US) 1997-04-09 EP disclosed
US-5605922-A VISION DISORDERS; SIDE EFFECT REDUCTION ALCON LABORATORIES, INC. (US) 1997-02-25 US disclosed
US-5523316-A COMPRISES AN ANTIOXIDANT/FREE RADICAL SCAVENGER, ELECTROLYTES, CELLULAR ENERGY SOURCE, BICARBONATE AND A BUFFER ALCON LABORATORIES, INC. (US) 1996-06-04 US disclosed
EP-0664707-A1 COMBINATIONS OF PROSTAGLANDINS AND CLONIDINE DERIVATIVES FOR THE TREATMENT OF GLAUCOMA. ALCON LAB INC (US) 1995-08-02 EP disclosed
WO-1994008585-A1 COMBINATIONS OF PROSTAGLANDINS AND CLONIDINE DERIVATIVES FOR THE TREATMENT OF GLAUCOMA ALCON LABORATORIES, INC. (US) 1994-04-28 WO disclosed
EP-0365662-B1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS ALCON LAB INC (US) 1994-03-09 EP disclosed
EP-0365662-A4 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS 1990-10-24 EP disclosed
EP-0365662-A1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS. ALCON LAB INC (US) 1990-05-02 EP disclosed
WO-1989010126-A1 ANTIGLAUCOMA COMPOSITIONS CONTAINING COMBINATIONS OF ALPHA-2 AGONISTS AND BETA-BLOCKERS ALCON LABORATORIES, INC. (US) 1989-11-02 WO disclosed