SCHEMBL7297435

SCHEMBL7297435

CCn1ccnc1SC(C)(C)C[O]

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.31
FDPS P14324 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
TLR8 Q9NR97 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL7297429 0.73 KMT2A (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL7350391 0.70 KMT2A (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL28198306 0.69 SMN1; SMN2 (0.37) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL3868248 0.67 GAA (0.35) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL464563 0.65 KCNH2 (0.43) KMT2AALDH1A1POLBMAPTFDPS
SCHEMBL8541839 0.64 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL2283802 0.64
SCHEMBL20518770 0.64
SCHEMBL19262387 0.63
SCHEMBL19386625 0.62 EHMT2 (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1POLB

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-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed