SCHEMBL8543474

SCHEMBL8543474

N#CC1=C(N)Oc2c(ccc3ccccc23)C1c1ccccc1C(F)(F)F

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MYB P10242 14/20 0.63
MAPT P10636 3/20 0.60
MEN1 O00255 2/20 0.60
LMNA P02545 2/20 0.60
KMT2A Q03164 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 1/20 0.60
GAA P10253 2/20 0.59
RAB9A P51151 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CYP1A2 P05177 1/20 0.53

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
SCHEMBL14952249 0.84 MYB (0.73) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8544234 0.83 MYB (0.75) MYBMAPTMEN1LMNAKMT2A
SCHEMBL14952246 0.82 MYB (0.67) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8543701 0.81 MYB (0.70) MYBMAPTMEN1LMNAKMT2A
SCHEMBL31237908 0.80 MYB (0.83) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8540816 0.79 MYB (0.41) MYBMAPTMEN1LMNAKMT2A
SCHEMBL14478940 0.79 MYB (0.73) MYB
SCHEMBL8537195 0.78 MYB (0.67) MYBMAPTMEN1LMNAKMT2A
SCHEMBL14952248 0.78 MYB (0.71) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8542892 0.77 MYB (0.69) MYBMAPTMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0537949-B1 Antiproliferative derivatives of 4H-naphtho 1,2-b pyran LILLY CO ELI (GB) 1998-07-01 EP disclosed
US-5284868-A Naphthopyran derivatives; for autoimmune diseases, cancer ELI LILLY AND COMPANY (US) 1994-02-08 US disclosed
US-5281619-A Administering naphtho(1,2-B)pyran derivatives ELI LILLY AND COMPANY (US) 1994-01-25 US disclosed
EP-0537949-A1 Antiproliferative derivatives of 4H-naphtho 1,2-b pyran LILLY INDUSTRIES LIMITED (GB) 1993-04-21 EP disclosed