SCHEMBL10736059

SCHEMBL10736059

CCCC[Sn](CCCC)(CCCC)Sc1nc2cc(C)ccc2c(=O)n1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 4/20 0.50
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ NPY1R P25929 1/20 0.45
▸ NPY2R P49146 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ PDE7B Q9NP56 1/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ PNP P00491 2/20 0.43
▸ CHEK1 O14757 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL10733969 0.89 PDE7A (0.63) PDE7AALDH1A1LMNANPY1RNPY2R
SCHEMBL10737796 0.86 PDE7A (0.47) PDE7AALDH1A1LMNANPY1RNPY2R
SCHEMBL10733928 0.81 PDE7A (0.49) PDE7AALDH1A1PDE7BNPSR1MAPT
SCHEMBL10740743 0.80 LMNA (0.65) PDE7AALDH1A1LMNANPY1RNPY2R
SCHEMBL10737344 0.80 KDR (0.54) PDE7AALDH1A1LMNANPSR1MAPT
SCHEMBL10738200 0.76 PDE7A (0.51) PDE7AALDH1A1PDE7BNPSR1MAPT
SCHEMBL10735119 0.73 TDP1 (0.57) ALDH1A1L3MBTL1NPSR1MAPTSMN1; SMN2
SCHEMBL10742088 0.72 ALDH1A1 (0.44) PDE7AALDH1A1LMNANPY1RNPY2R
SCHEMBL10733448 0.71 SMN1; SMN2 (0.47) L3MBTL1NPSR1SMN1; SMN2
SCHEMBL10739940 0.71 TDP1 (0.64) ALDH1A1LMNANPSR1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4652558-A FUNGICIDES, INSECTICIDES CHEVRON RESEARCH COMPANY (US) 1987-03-24 — — US disclosed
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