SCHEMBL9503608

SCHEMBL9503608

CCCC(=O)OC(=O)CCCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 1/20 0.58
CTNNB1 P35222 1/20 0.58
MAPT P10636 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
KCNH2 Q12809 3/20 0.49
TSHR P16473 1/20 0.49
MGLL Q99685 2/20 0.44
FAAH O00519 1/20 0.44
KCNJ1 P48048 2/20 0.43
EIF4A1 P60842 1/20 0.43

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
SCHEMBL9503602 0.93 MAPT (0.56) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL11577381 0.87 TSHR (0.53) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL7188600 0.84 MAPT (0.55) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL1350599 0.84 MAPT (0.55) BCL9CTNNB1MAPTKMT2AALDH1A1
Hydrochloric Acid SCHEMBL6988461 0.83 MAPT (0.54) BCL9CTNNB1MAPTKMT2AALDH1A1
Butyric Acid SCHEMBL28859113 0.82 BCL9 (0.69) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL16346780 0.82 ALDH1A1 (0.64) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL5024676 0.81 MAPT (0.52) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL15154022 0.81 MAPT (0.54) BCL9CTNNB1MAPTKMT2AALDH1A1
SCHEMBL14075558 0.81 MAPT (0.54) BCL9CTNNB1MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0322003-B1 AZOMETHINE DYE DERIVED FROM A COMPOUND HAVING A PYRAZOLO TRIAZOLE MOIETY FUJI PHOTO FILM CO., LTD. (JP) 1993-06-23 EP disclosed
EP-0119860-B1 PYRAZOLO MAGENTA COUPLERS USED IN SILVER HALIDE PHOTOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1989-10-25 EP disclosed
EP-0322003-A2 Azomethine dye derived from a compound having a pyrazolo triazole moiety FUJI PHOTO FILM CO., LTD. (JP) 1989-06-28 EP disclosed
US-4621046-A MAGENTA COLOR IMAGE FORMING COUPLERS FUJI PHOTO FILM CO., LTD. (JP) 1986-11-04 US disclosed
US-4540654-A Method of forming color image comprising heterocyclic magenta dye-forming coupler FUJI PHOTO FILM CO., LTD. (JP) 1985-09-10 US disclosed
EP-0119860-A2 Pyrazolo magenta couplers used in silver halide photography FUJI PHOTO FILM CO., LTD. (JP) 1984-09-26 EP disclosed