SCHEMBL9688914

SCHEMBL9688914

COC(=O)Oc1c(C)nc2[nH]c3ccccc3c2c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.42
HSD17B10 Q99714 5/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 3/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 1/20 0.42
ABCB1 P08183 2/20 0.40
TUBB3 Q13509 2/20 0.40
NR4A2 P43354 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GABRP O00591 3/20 0.39
GABRD O14764 3/20 0.39
GABRA1 P14867 3/20 0.39
GABRB1 P18505 3/20 0.39
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39

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
SCHEMBL9690370 0.89 EGFR (0.42) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL9690330 0.85 MEN1 (0.42) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL9690098 0.78 HSD17B10 (0.44) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL9689731 0.78 HSD17B10 (0.48) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL6656429 0.77 HSD17B10 (0.56) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL27600329 0.76 GSK3B (0.44) KDM4EHSD17B10ALDH1A1HPGDKMT2A
SCHEMBL9689797 0.74 GABRP (0.68) KDM4EHSD17B10ALDH1A1HPGDLMNA
SCHEMBL6650935 0.72 ACHE (0.42) HSD17B10TP53
SCHEMBL8809770 0.70 NR4A2 (0.49) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL27618833 0.69 EGFR (0.54) KDM4EHSD17B10ALDH1A1HPGDLMNA

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-0249301-B1 Pyrido[2,3-b]indoles BEECHAM GROUP PLC (GB) 1992-05-27 EP claimed