SCHEMBL30289850

SCHEMBL30289850

Cc1cc(C)cc(Nc2nc3cc(F)c(F)cc3c(=O)[nH]2)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.65
▸ KMT2A Q03164 5/20 0.65
▸ MEN1 O00255 3/20 0.65
▸ KDM4E B2RXH2 3/20 0.65
▸ RAB9A P51151 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ GAA P10253 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ CREBBP Q92793 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL30289960 0.86 MAPT (0.47) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289989 0.83 MEN1 (0.45) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289846 0.81 KMT2A (0.62) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL4368274 0.77 KDM4E (0.62) MAPTKDM4ERAB9ASMN1; SMN2GAA
SCHEMBL30289847 0.75 MAPT (0.64) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289806 0.72 MAPT (0.45) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289840 0.72 MEN1 (0.53) MAPTKMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL30289914 0.71 PARP1 (0.56) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289904 0.70 MAPT (0.52) MAPTKMT2AMEN1KDM4ERAB9A
SCHEMBL30289793 0.70 MAPT (0.55) MAPTKMT2AMEN1KDM4ERAB9A

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
Send feedback