SCHEMBL8368653

SCHEMBL8368653

O=C1C=C(Nc2ccccc2)C(=O)c2nccnc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.70
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
ALDH1A1 P00352 4/20 0.70
TDP1 Q9NUW8 4/20 0.70
GUCY1B2 O75343 1/20 0.70
GUCY1A2 P33402 1/20 0.70
GUCY1A1 Q02108 1/20 0.70
GUCY1B1 Q02153 1/20 0.70
BLM P54132 5/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
RAB9A P51151 4/20 0.56
CASP3 P42574 4/20 0.56
SENP8 Q96LD8 4/20 0.56
SENP7 Q9BQF6 4/20 0.56
SENP6 Q9GZR1 4/20 0.56
LMNA P02545 3/20 0.56
HTT P42858 3/20 0.56
NPC1 O15118 3/20 0.56

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
SCHEMBL8371672 0.84 CDK4 (0.58) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8367302 0.84 CDK4 (0.56) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL970943 0.83 MAPT (1.00) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL29401747 0.83 MAPT (1.00) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8651660 0.83 MAPT (0.78) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10778656 0.82 KMT2A (0.50) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8368911 0.82 MAPT (0.50) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8368850 0.82 SMN1; SMN2 (0.50) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8368885 0.80 MEN1 (0.48) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL8369508 0.80 CDK4 (0.60) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0107365-B1 6-ANILINO-5,8-QUINOXALINEDIONES ELI LILLY AND COMPANY (US) 1987-07-22 EP claimed
EP-0107365-A2 6-Anilino-5,8-quinoxalinediones ELI LILLY AND COMPANY (US) 1984-05-02 EP claimed
WO-1999052365-A1 ANTICANCER AGENTS ELI LILLY AND COMPANY (US) 1999-10-21 WO disclosed
EP-0107365-B1 6-ANILINO-5,8-QUINOXALINEDIONES ELI LILLY AND COMPANY (US) 1987-07-22 EP disclosed
EP-0107365-B1 6-ANILINO-5,8-QUINOXALINEDIONES ELI LILLY AND COMPANY (US) 1987-07-22 EP disclosed
US-4486432-A ANTIASTHMA ELI LILLY AND COMPANY (US) 1984-12-04 US disclosed
EP-0107365-A2 6-Anilino-5,8-quinoxalinediones ELI LILLY AND COMPANY (US) 1984-05-02 EP disclosed
EP-0107365-A2 6-Anilino-5,8-quinoxalinediones ELI LILLY AND COMPANY (US) 1984-05-02 EP disclosed
EP-0107365-A2 6-Anilino-5,8-quinoxalinediones ELI LILLY AND COMPANY (US) 1984-05-02 EP disclosed