SCHEMBL7816985

SCHEMBL7816985

COc1c(C(=O)CC(C)C)c(=O)[nH]c2c(OC)cccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
HPGD P15428 6/20 0.44
KDM4E B2RXH2 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
GAA P10253 2/20 0.44
POLB P06746 2/20 0.44
MAPT P10636 2/20 0.44
MCL1 Q07820 2/20 0.44
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44

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
SCHEMBL7811009 0.84 ALDH1A1 (0.56) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL7804238 0.81 KDM4E (0.49) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL6579896 0.72 ALDH1A1 (0.61) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL29957066 0.71 ALDH1A1 (0.60) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL6576708 0.68 ALDH1A1 (0.56) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL28238876 0.66 CA12 (0.55) ALDH1A1HPGDKMT2APOLBHTT
SCHEMBL3423322 0.65 NQO2 (0.57) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL13647205 0.65 NPC1 (0.58) ALDH1A1HPGDKMT2APOLBHTT
SCHEMBL28325027 0.65 KDM4E (0.62) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL14979872 0.64 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EMEN1KMT2A

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-0533882-B1 2-QUINOLINONE DERIVATIVES, METHODS FOR PREPARING THE SAME AND FUNGICIDES AND INSECTICIDES INCLUDING THEM KOREA RES INST CHEM TECH (KR) 2001-02-07 EP disclosed
US-5430153-A Insecticides, fungicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-04 US disclosed
EP-0533882-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-03-31 EP disclosed
WO-1992017452-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-10-15 WO disclosed