SCHEMBL6449751

SCHEMBL6449751

C=CCSc1cccc2nnnn12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
L3MBTL1 Q9Y468 3/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
UBE2M P61081 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32
KDM1A O60341 1/20 0.32
PARP1 P09874 1/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL7966725 0.68 L3MBTL1 (0.36) ALDH1A1L3MBTL1MAPTRAB9AMEN1
SCHEMBL7627196 0.63 KMT2A (0.62) ALDH1A1L3MBTL1MAPTRAB9AMEN1
SCHEMBL429354 0.63 GABRA1 (0.38) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL3209050 0.63 CYP11B2 (0.37) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL3205487 0.63 AHR (0.41) ALDH1A1L3MBTL1
SCHEMBL1286245 0.63 KDM4E (0.35) ALDH1A1L3MBTL1MEN1KMT2AHPGD
SCHEMBL14672809 0.63 KMT2A (0.33) ALDH1A1L3MBTL1MAPTRAB9AMEN1
SCHEMBL7915878 0.62 ALDH1A1 (0.33) ALDH1A1L3MBTL1HPGDTSHR
SCHEMBL3263004 0.59 MEN1 (0.41) ALDH1A1L3MBTL1MAPTRAB9AMEN1
SCHEMBL7966722 0.59 ALDH1A1 (0.40) ALDH1A1L3MBTL1MAPTRAB9AKMT2A

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-1193543-B1 Black and white graphic arts film EASTMAN KODAK CO (US) 2005-05-25 EP disclosed