SCHEMBL30289906

SCHEMBL30289906

O=c1[nH]c(Nc2ccc(Cl)c(Cl)c2)nc2c(Cl)ccc(Cl)c12

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 2/20 0.57
▸ MAPT P10636 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MAPK1 P28482 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ LCK P06239 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GRM4 Q14833 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
SCHEMBL30289853 0.86 MAPT (0.48) POLA1MAPTMEN1KMT2ALMNA
SCHEMBL30289911 0.83 POLA1 (0.41) POLA1MAPTMEN1KMT2ALMNA
SCHEMBL30289910 0.81 POLA1 (0.55) POLA1MAPTMEN1KMT2ACYP3A4
SCHEMBL30289893 0.75 AKT1 (0.40) RAB9ASMN1; SMN2LCKALDH1A1
SCHEMBL30289871 0.74 KDM4E (0.49) LCKALDH1A1
SCHEMBL30289899 0.73 CXCR2 (0.41) POLA1LCK
SCHEMBL22245126 0.70 POLA1 (0.50) POLA1MAPTMEN1KMT2ACYP3A4
SCHEMBL22161999 0.70 POLA1 (0.50) POLA1MAPTMEN1KMT2ACYP3A4
SCHEMBL12344710 0.69 POLA1 (0.49) POLA1MAPTKMT2ACYP3A4RECQL
SCHEMBL30289877 0.69 XDH (0.49) MEN1KMT2ALMNAPOLBHTT

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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