SCHEMBL30935740

SCHEMBL30935740

O=c1cc(-c2ccccc2)[nH]c2ccc(Cl)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 1.00
ALDH1A1 P00352 6/20 1.00
MEN1 O00255 6/20 1.00
HPGD P15428 6/20 0.77
LMNA P02545 5/20 0.77
THRB P10828 1/20 0.74
NPC1 O15118 3/20 0.73
RAB9A P51151 3/20 0.73
KDM4E B2RXH2 6/20 0.69
PDE10A Q9Y233 2/20 0.69
HSD17B10 Q99714 3/20 0.68
TP53 P04637 2/20 0.68
MAPT P10636 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
NPSR1 Q6W5P4 2/20 0.68
CTSV O60911 1/20 0.68
TUBB4A P04350 1/20 0.68
TUBB P07437 1/20 0.68
CTSL P07711 1/20 0.68
TUBA3C P0DPH7 1/20 0.68

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
SCHEMBL6295907 0.89 ALDH1A1 (0.81) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL9390802 0.87 LMNA (1.00) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL2630603 0.83 HPGD (0.76) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL30462938 0.82 KDM4E (1.00) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL29411863 0.81 HPGD (1.00) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL367268 0.81 HPGD (1.00) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL9385766 0.81 HPGD (0.68) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL2799465 0.81 HPGD (1.00) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL1273139 0.81 HPGD (0.68) KMT2AALDH1A1MEN1HPGDLMNA
SCHEMBL6534299 0.81 HPGD (1.00) KMT2AALDH1A1MEN1HPGDLMNA

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
CN-118108771-A Method for preparing quinolone compound by high-efficiency catalysis of pyridine palladium 安康学院 2024-05-31 CN disclosed