SCHEMBL9183045

SCHEMBL9183045

CC(=O)Oc1ccc(CSc2nnnn2-c2cccc(N)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
LMNA P02545 5/20 0.56
MAPK1 P28482 3/20 0.49
ATM Q13315 1/20 0.49
MAPT P10636 1/20 0.48
HPGD P15428 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 3/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PKM P14618 1/20 0.48
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
ESR1 P03372 1/20 0.45

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
SCHEMBL11875780 0.88 ALDH1A1 (0.72) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL9186272 0.81 ALDH1A1 (0.52) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL11878906 0.73 ALDH1A1 (0.64) ALDH1A1LMNAMAPK1MAPTHPGD
SCHEMBL7936744 0.72 ALDH1A1 (0.58) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL7935217 0.72 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL6536923 0.72 ALDH1A1 (0.57) ALDH1A1LMNAMAPK1MAPTHPGD
SCHEMBL9186282 0.71 ALDH1A1 (0.47) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL10664251 0.70 SMN1; SMN2 (0.70) ALDH1A1LMNAMAPK1MAPTHPGD
SCHEMBL11872723 0.68 ALDH1A1 (0.81) ALDH1A1LMNAMAPK1ATMMAPT
SCHEMBL6509396 0.68 ALDH1A1 (0.66) ALDH1A1LMNAMAPK1ATMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450198-B1 Developer liquid for high contrast development AGFA GEVAERT NV (BE) 1995-07-26 EP disclosed
US-5141843-A Phenyl tetrazole anti-fogging agent AGFA-GEVAERT N. V. (BE) 1992-08-25 US disclosed
EP-0450198-A1 Developer liquid for high contrast development AGFA-GEVAERT N.V. (BE) 1991-10-09 EP disclosed