SCHEMBL28097938

SCHEMBL28097938

CNCc1nc2cc(Cl)ccc2c(=O)[nH]1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.57
▸ PIM2 Q9P1W9 1/20 0.57
▸ POLB P06746 2/20 0.56
▸ LMNA P02545 2/20 0.54
▸ KMT2A Q03164 4/20 0.52
▸ MAPT P10636 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ ATM Q13315 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ GAA P10253 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ HPGD P15428 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ PDE5A O76074 1/20 0.49
▸ TUBB4A P04350 2/20 0.48
▸ TUBB P07437 2/20 0.48
▸ TUBA3C P0DPH7 2/20 0.48

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
SCHEMBL17298013 0.84 TNKS2 (0.62) POLBLMNAKMT2AMAPTMEN1
SCHEMBL24807018 0.83 POLB (0.51) POLBLMNAKMT2AMAPTMEN1
SCHEMBL6929589 0.82 KDM4E (0.65) POLBLMNAKMT2AMAPTMEN1
SCHEMBL29900514 0.82 KDM4E (0.65) POLBLMNAKMT2AMAPTMEN1
SCHEMBL28097943 0.81 POLB (0.56) POLBLMNAKMT2AMAPTMEN1
SCHEMBL19104694 0.80 LMNA (0.54) POLBLMNAKMT2AMAPTMEN1
SCHEMBL2261181 0.79 TNKS2 (0.69) POLBLMNAKMT2AMAPTMEN1
SCHEMBL7366882 0.79 PKM (0.59) PIM1PIM2TDP1GAAALDH1A1
SCHEMBL24807720 0.78 LMNA (0.50) POLBLMNAKMT2AMAPTMEN1
SCHEMBL1891979 0.76 LMNA (0.56) POLBLMNAKMT2AMAPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106045922-A 2-(Amino) methylquinazolin-4(3H)-one compound and preparation method and application thereof 湘潭大学 2016-10-26 — — CN claimed
CN-106045922-A 2-(Amino) methylquinazolin-4(3H)-one compound and preparation method and application thereof 湘潭大学 2016-10-26 — — CN disclosed
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