SCHEMBL9101234

SCHEMBL9101234

NC(=O)c1cc2ccccc2c2c3c(oc12)C(=O)c1ccccc1C3=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRK6 P43250 1/20 0.46
▸ EGFR P00533 6/20 0.46
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ PDGFRB P09619 5/20 0.39
▸ FGFR1 P11362 5/20 0.39
▸ KDR P35968 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 3/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ APAF1 O14727 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MITF O75030 1/20 0.39
▸ NTRK1 P04629 1/20 0.39
▸ PLK3 Q9H4B4 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL9435886 0.82 F12 (0.47) EGFRKDRMAPTHTTKMT2A
SCHEMBL11572129 0.78 NPC1 (0.48) EGFRPDGFRBFGFR1KDRALDH1A1
SCHEMBL9436106 0.75 EGFR (0.41) EGFRPDGFRBFGFR1KDRALDH1A1
SCHEMBL7568567 0.73 EGFR (0.56) EGFRPDGFRBFGFR1KDRALDH1A1
SCHEMBL7575236 0.71 NTRK1 (0.55) EGFRMAPTKMT2AL3MBTL1NTRK1
SCHEMBL2681675 0.68 ABCG2 (0.49) ALDH1A1MAPTHTTKMT2ANTRK1
SCHEMBL7574891 0.68 NTRK1 (0.44) EGFRALDH1A1MAPTKMT2ARAB9A
SCHEMBL29892465 0.66 MAPT (0.68) GRK6KEAP1NFE2L2FGFR1ALDH1A1
SCHEMBL27157150 0.66 MAPT (0.68) GRK6KEAP1NFE2L2FGFR1ALDH1A1
SCHEMBL7570053 0.66 SOS1 (0.56) EGFRALDH1A1MAPTHTTKMT2A

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-5543631-A N-2''-PYRIDYL-8,13-DIOXODINAPHTHO(2,1-B:2',3'-D)FURAN-6-CARBO XAMIDE, SWITCHES WEINBERGER LESTER (US) 1996-08-06 — — US disclosed
Send feedback