SCHEMBL9770452

SCHEMBL9770452

Cn1c(Cc2ccccc2)cc(=O)n1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.57
IDH1 O75874 8/20 0.46
BCHE P06276 4/20 0.42
ALOX15 P16050 2/20 0.42
PTGS2 P35354 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL4322718 0.83 NAPRT (0.61) NAPRTBCHEALOX15PTGS2ALDH1A1
SCHEMBL9770457 0.79 IDH1 (0.45) NAPRTIDH1ALOX15ALDH1A1LMNA
SCHEMBL17034725 0.78 NAPRT (0.54) NAPRTBCHEALOX15PTGS2ALDH1A1
SCHEMBL9770216 0.74 NAPRT (0.62) NAPRTBCHEALOX15PTGS2ALDH1A1
Antipyrine SCHEMBL20452 0.73 NAPRT (1.00) NAPRTBCHEALOX15PTGS2ALDH1A1
SCHEMBL22689599 0.72 KDM4E (0.63) NAPRTBCHEALOX15PTGS2ALDH1A1
SCHEMBL7842787 0.72 NAPRT (0.65) NAPRTBCHEALOX15PTGS2ALDH1A1
Antipyrine SCHEMBL18260589 0.72 NAPRT (0.96) NAPRTBCHEALOX15PTGS2ALDH1A1
Antipyrine SCHEMBL8736656 0.72 NAPRT (0.96) NAPRTBCHEALOX15PTGS2ALDH1A1
Antipyrine SCHEMBL8995343 0.72 NAPRT (0.96) NAPRTBCHEALOX15PTGS2ALDH1A1

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-4981836-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1991-01-01 US disclosed
US-4918045-A SUPPORTS, MICROCAPSULES CONTAINING COLORLESS ELECTRON-DONATING COLOR FORMER AND SOLVENT, AND ELECTRON-ACCEPTING DEVELOPER FUJI PHOTO FILM CO., LTD. (JP) 1990-04-17 US disclosed
US-4888321-A SUBBING AND RECORDING LAYERS EACH CONTAINING HEAT FUSIBLE MATERIAL WITH DEFINED MELTING POINT FUJI PHOTO FILM CO., LTD. (JP) 1989-12-19 US disclosed
US-4876233-A NICKEL COMPOUNDS; COLORFASTNESS FUJI PHOTO FILM CO., LTD. (JP) 1989-10-24 US disclosed
US-4871713-A Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1989-10-03 US disclosed
US-4870048-A COLORFAST IMAGE, LIGHT RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1989-09-26 US disclosed
US-4839332-A AMINO-SUBSTITUTED FLUORENE AND ACID; DISCOLORATION INHIBITON, CHEMICAL RESISTANCE FUJI PHOTO FILM CO., LTD. (JP) 1989-06-13 US disclosed
US-4835133-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1989-05-30 US disclosed
US-4833118-A COLOR DEVELOPERS, SUBBING LAYERS, AROMATIC ESTERS OR CARBONATES FUJI PHOTO FILM CO., LTD. (JP) 1989-05-23 US disclosed
EP-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed