SCHEMBL29477209

SCHEMBL29477209

O=C(CCl)Nc1nc2ccc(Cl)cc2s1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.70
FSCN1 Q16658 1/20 0.70
CASP2 P42575 1/20 0.68
CASP3 P42574 9/20 0.65
SENP7 Q9BQF6 9/20 0.65
SENP8 Q96LD8 8/20 0.65
SENP6 Q9GZR1 8/20 0.65
NPC1 O15118 4/20 0.65
MAPT P10636 2/20 0.65
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
POLB P06746 2/20 0.63
CLK1 P49759 1/20 0.63
PTPN1 P18031 1/20 0.62
CSNK1D P48730 4/20 0.61
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KDM4E B2RXH2 2/20 0.58
NFKB1 P19838 1/20 0.58
NFKB2 Q00653 1/20 0.58

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
SCHEMBL27173084 1.00 DYRK1A (0.70) DYRK1AFSCN1CASP2CASP3SENP7
SCHEMBL7923452 0.87 DYRK1A (0.68) DYRK1AFSCN1CASP3SENP7SENP8
SCHEMBL9893074 0.87 DYRK1A (0.72) DYRK1AFSCN1CASP3SENP7SENP8
SCHEMBL5928965 0.86 DYRK1A (0.75) DYRK1AFSCN1CASP3SENP7SENP8
SCHEMBL4488390 0.85 CASP2 (0.66) DYRK1AFSCN1CASP2NPC1MAPT
SCHEMBL30849479 0.84 RAB9A (0.68) DYRK1ACASP2NPC1MAPTMEN1
SCHEMBL17251987 0.84 PDPK1 (0.68) DYRK1ACASP2NPC1MAPTMEN1
SCHEMBL29477216 0.84 RAB9A (0.72) DYRK1ACASP2NPC1MAPTMEN1
SCHEMBL27173184 0.84 RAB9A (0.68) DYRK1ACASP2NPC1MAPTMEN1
SCHEMBL11920138 0.84 RAB9A (0.72) DYRK1ACASP2NPC1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024177606-A1 QUINAZOLINONE DERIVATIVE COMPOUNDS SHOWING ANTI-CANCER ACTIVITY AND THE SYNTHESIS METHODS OF THESE COMPOUNDS BILECIK SEYH EDEBALI UNIVERSITESI (TR) 2024-08-29 WO claimed
EP-3959200-A1 NEW TRIAZOLE AND TRIAZOLOTHIADIAZINE DERIVATIVES EXERTING CYTOTOXIC AND APOPTOTIC EFFECTS ON A549 CELLS THROUGH AKT INHIBITION Anadolu Universitesi (TR) 2022-03-02 EP claimed
CN-119954794-A Flavonol derivative containing benzothiazole, and preparation method and application thereof 贵州大学 2025-05-09 CN disclosed
WO-2024177606-A1 QUINAZOLINONE DERIVATIVE COMPOUNDS SHOWING ANTI-CANCER ACTIVITY AND THE SYNTHESIS METHODS OF THESE COMPOUNDS BILECIK SEYH EDEBALI UNIVERSITESI (TR) 2024-08-29 WO disclosed