SCHEMBL10922894

SCHEMBL10922894

O=C(O)c1cnc2cc(N3CCSCC3)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.49
▸ HDAC3 O15379 5/20 0.46
▸ HDAC1 Q13547 3/20 0.46
▸ HDAC2 Q92769 3/20 0.46
▸ TERT O14746 2/20 0.41
▸ EGLN1 Q9GZT9 4/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ LGMN Q99538 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MTOR P42345 1/20 0.37
▸ HPGDS O60760 1/20 0.36
▸ CHEK1 O14757 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
SCHEMBL15681572 0.86 TERT (0.56) MGAMHDAC3HDAC1HDAC2TERT
SCHEMBL21835803 0.84 CHEK1 (0.53) MGAMHDAC3HDAC1HDAC2KDM4E
SCHEMBL8727055 0.84 HDAC3 (0.60) MGAMHDAC3HDAC1HDAC2TERT
Hydrochloric Acid SCHEMBL15534244 0.83 HDAC3 (0.59) MGAMHDAC3HDAC1HDAC2KCNH2
SCHEMBL17737093 0.80 KDM4E (0.47) MAPTTHRBLGMNKDM4EMEN1
SCHEMBL11014645 0.78 MGAM (0.45) MGAMHDAC3HDAC1HDAC2KCNH2
SCHEMBL27971212 0.77 MGAM (0.53) MGAMTERTEGLN1MAPTKDM4E
SCHEMBL15666121 0.77 CKS1B (0.48) MAPTMEN1ALDH1A1KMT2A
SCHEMBL10619057 0.76 MAPT (0.40) MGAMHDAC3HDAC1HDAC2MAPT
SCHEMBL27970978 0.76 MGAM (0.51) MGAMTERTEGLN1MAPTKDM4E

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
EP-0090424-B1 NEW QUINOLONE COMPOUNDS AND PREPARATION THEREOF STERLING DRUG INC. (US) 1986-05-28 — — EP disclosed
Send feedback