SCHEMBL7899185

SCHEMBL7899185

Nc1cccc(NC(=S)NC2=CC[CH]C=C2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALDH1A1 P00352 5/20 0.46
MAPK1 P28482 1/20 0.46
DDX3X O00571 1/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
GFER P55789 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
IDO1 P14902 3/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35

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
SCHEMBL7899132 0.85 KMT2A (0.56) MAPTALDH1A1KMT2AMEN1RAB9A
SCHEMBL7979005 0.83 ALDH1A1 (0.55) MAPTALDH1A1KMT2AMEN1RAB9A
SCHEMBL7868513 0.82 MEN1 (0.45) MAPTALDH1A1KMT2AMEN1RAB9A
SCHEMBL7639487 0.82 ALDH1A1 (0.52) MAPTALDH1A1MAPK1KMT2AMEN1
SCHEMBL7638272 0.82 ALDH1A1 (0.44) MAPTALDH1A1MAPK1KMT2AMEN1
SCHEMBL7640046 0.81 MAPT (0.58) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL7645762 0.81 GRIN2D (0.40) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL7593147 0.81 MAPT (0.60) MAPTALDH1A1MAPK1KMT2AMEN1
SCHEMBL7908521 0.81 MAPT (0.56) MAPTALDH1A1KMT2AMEN1RAB9A
SCHEMBL7642171 0.80 ALDH1A1 (0.41) MAPTALDH1A1KMT2AMEN1RAB9A

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
US-6197803-B1 VIRICIDES; PREVENTION REPRODUCTION AMERICAN HOME PRODUCTS CORPORATION 2001-03-06 US disclosed