SCHEMBL30289833

SCHEMBL30289833

COc1cccc2nc(Nc3cc(F)cc(F)c3)[nH]c(=O)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.45
▸ MMP13 P45452 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ PARP1 P09874 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ STK10 O94804 1/20 0.41
▸ SLK Q9H2G2 1/20 0.41
▸ ELANE P08246 2/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ PDE3B Q13370 1/20 0.40

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
SCHEMBL30289844 0.86 MAPT (0.52) MAPTMEN1KMT2AKDM4EMMP13
SCHEMBL30289798 0.81 MAPT (0.45) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL30289840 0.79 MEN1 (0.53) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL30289854 0.76 KDM4E (0.71) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL32666079 0.71 KDM4E (0.67) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL25338930 0.70 ELANE (0.56) MEN1KMT2AKDM4EMMP13ALDH1A1
SCHEMBL1996492 0.69 MEN1 (0.60) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL30289960 0.69 MAPT (0.47) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL26438897 0.69 ELANE (0.48) KDM4EMMP13ALDH1A1HPGDPARP1
SCHEMBL30289911 0.69 POLA1 (0.41) MAPTMEN1KMT2AKDM4ETAAR1

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
WO-2023054759-A1 2-AMINOQUINAZOLINE DERIVATIVE AND ANTI-VIRAL COMPOSITION COMPRISING SAME 한국화학연구원 2023-04-06 — — WO disclosed
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