SCHEMBL7300323

SCHEMBL7300323

CCOC(=O)CCCn1c(=O)[nH]c(=O)c2cc(OC)ccc21

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.48
KDM4E B2RXH2 2/20 0.48
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
TNF P01375 3/20 0.46
PLA2G2A P14555 2/20 0.44
SYK P43405 1/20 0.44
EGFR P00533 1/20 0.44
DYRK1A Q13627 1/20 0.43
TSHR P16473 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
SCHEMBL10487896 0.86 MAPT (0.57) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL7306990 0.86 KDM4E (0.49) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL7308089 0.83 TNF (0.62) HSD17B10KDM4EMAPTTNF
SCHEMBL7310111 0.82 MAOA (0.46) HSD17B10KDM4EKMT2AMEN1MAPT
SCHEMBL7649974 0.80 MAPK10 (0.55) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL7298112 0.79 MAOA (0.46) HSD17B10KDM4EKMT2AMEN1MAPT
SCHEMBL14266806 0.79 PLA2G2A (0.50) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL7309296 0.79 TDP1 (0.47) HSD17B10KDM4EALDH1A1ALOX15TNF
SCHEMBL10487880 0.77 ALDH1A1 (0.49) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL355062 0.77 PSEN1 (0.54) HSD17B10KDM4EKMT2AMEN1ALDH1A1

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
EP-0481342-A1 Quinazoline derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed