SCHEMBL30289806

SCHEMBL30289806

O=c1[nH]c(Nc2cc(F)cc(F)c2)nc2cc(Cl)c(Cl)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLA1 P09884 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ APAF1 O14727 1/20 0.35
▸ TDP2 O95551 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CDC25B P30305 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ BLM P54132 1/20 0.35

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
SCHEMBL30289858 0.86 MAPT (0.49) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289960 0.86 MAPT (0.47) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289840 0.80 MEN1 (0.53) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL30289854 0.79 KDM4E (0.71) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289811 0.78 MAPT (0.40) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289904 0.78 MAPT (0.52) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289989 0.78 MEN1 (0.45) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289841 0.77 MAPT (0.40) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289842 0.76 KDM4E (0.47) MAPTMEN1KMT2AKDM4ERAB9A
SCHEMBL30289911 0.74 POLA1 (0.41) MAPTMEN1KMT2AKDM4ESMN1; SMN2

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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