SCHEMBL9776325

SCHEMBL9776325

[CH2]CC(=O)C(C)C(=O)CC

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 2/20 0.32
FFAR3 O14843 1/20 0.32

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
SCHEMBL2546877 0.86 ALDH1A1 (0.41) ALDH1A1TSHRTDP1FFAR3
SCHEMBL28279631 0.75 TDP1 (0.37) ALDH1A1TSHRTDP1FFAR3
SCHEMBL7914140 0.74 ALDH1A1 (0.42) ALDH1A1TSHRFFAR3
SCHEMBL20278704 0.74
SCHEMBL166454 0.72
SCHEMBL1741617 0.72
SCHEMBL9315437 0.72
SCHEMBL14643904 0.72
SCHEMBL7965201 0.72 TDP1 (0.35) ALDH1A1TSHRTDP1FFAR3
SCHEMBL2045366 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5069991-A NAPHTHOLACTAM OR ISINDOLENINE DYE BASF AKTIENGESELLSCHAFT (DE) 1991-12-03 US disclosed
EP-0364890-A2 Panchromatic electrophotographical recording element BASF Aktiengesellschaft (DE) 1990-04-25 EP disclosed
US-4906541-A Electrophotographic recording element containing a naphtholactam dye sensitizer BASF AKTIENGESELLSCHAFT (DE) 1990-03-06 US disclosed
EP-0318758-A2 Multilayered electrophotographical recording material BASF Aktiengesellschaft (DE) 1989-06-07 EP disclosed