SCHEMBL7751502

SCHEMBL7751502

C=CC(=O)NC1(NC(=O)C=C)CCCCCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TGM2 P21980 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
SCHEMBL3887596 0.80 TSHR (0.37) TSHRALDH1A1MAPK1TDP1
SCHEMBL8446682 0.78 TSHR (0.40) TSHRALDH1A1MAPK1TDP1
SCHEMBL10593961 0.77 ALDH1A1 (0.36) TSHRALDH1A1MAPK1TDP1TGM2
SCHEMBL10595642 0.77 ALDH1A1 (0.36) TSHRALDH1A1MAPK1TDP1TGM2
SCHEMBL21393151 0.75 TSHR (0.33) TSHRALDH1A1MAPK1TDP1
SCHEMBL8762317 0.74 ALDH1A1 (0.36) TSHRALDH1A1MAPK1TDP1TGM2
SCHEMBL12783026 0.74 TSHR (0.36) TSHRALDH1A1MAPK1TDP1
SCHEMBL12783023 0.74 TSHR (0.45) TSHRALDH1A1MAPK1TDP1
SCHEMBL9420527 0.72 HTT (0.36) TSHR
SCHEMBL19019111 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4626581-A CROSSLINKED ACRYLAMIDE INTERPOLYMERS BOARD OF REGENTS, UNIVERSITY OF TEXAS (US) 1986-12-02 US claimed
EP-1077952-A4 POLYMERIZABLE HYDROPHILIC ULTRAVIOLET LIGHT ABSORBING MONOMERS PHARMACIA & UPJOHN BV (NL) 2001-08-22 EP disclosed
EP-1077952-A1 POLYMERIZABLE HYDROPHILIC ULTRAVIOLET LIGHT ABSORBING MONOMERS Pharmacia & Upjohn Groningen BV (NL) 2001-02-28 EP disclosed
WO-1999058507-A1 POLYMERIZABLE HYDROPHILIC ULTRAVIOLET LIGHT ABSORBING MONOMERS PHARMACIA & UPJOHN GRONINGEN B.V. (NL) 1999-11-18 WO disclosed
US-5283196-A Polyacrylamide gels with improved detection of protein THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-02-01 US disclosed
WO-1989008100-A1 POLYACRYLAMIDE GELS FOR IMPROVED DETECTION OF PROTEINS UNITED STATES OF AMERICA, REPRESENTED BY THE SECRE (US) 1989-09-08 WO disclosed
EP-0330460-A2 Polyacrylamide gels for improved detection of proteins THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) 1989-08-30 EP disclosed
US-4626571-A Dihydroxyacryl BOARD OF REGENTS, UNIVERSITY OF TEXAS (US) 1986-12-02 US disclosed
US-4626581-A CROSSLINKED ACRYLAMIDE INTERPOLYMERS BOARD OF REGENTS, UNIVERSITY OF TEXAS (US) 1986-12-02 US disclosed
US-4584402-A Dihydroxyacryl BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1986-04-22 US disclosed