SCHEMBL8475706

SCHEMBL8475706

COc1cccc(CNC(=S)c2ccc3cccnc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
MAPT P10636 2/20 0.51
TP53 P04637 1/20 0.51
THRB P10828 1/20 0.51
SUCNR1 Q9BXA5 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
LIPG Q9Y5X9 1/20 0.45
HTT P42858 2/20 0.45
PKM P14618 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MMP13 P45452 1/20 0.44
PRKACA P17612 2/20 0.43
PRKX P51817 2/20 0.43
PRKCQ Q04759 2/20 0.43
ROCK1 Q13464 2/20 0.43
GRK5 P34947 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
ROCK2 O75116 1/20 0.43

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
SCHEMBL7010267 0.87 LMNA (0.61) LMNAMAPTTP53THRBSUCNR1
SCHEMBL8138354 0.80 MAOB (0.44) LMNAMAPTTP53THRBSUCNR1
SCHEMBL7019353 0.79 MAPT (0.57) LMNAMAPTTP53THRBSUCNR1
SCHEMBL7018462 0.77 KMT2A (0.52) LMNAHPGDKMT2ASMN1; SMN2ALDH1A1
SCHEMBL28042144 0.75 MAPK8 (0.51) LMNAMAPTTP53THRBHPGD
SCHEMBL617423 0.74 KMT2A (0.62) LMNAMAPTTP53THRBHPGD
SCHEMBL7014947 0.74 EGLN1 (0.64) LMNAMAPTSUCNR1HPGDKMT2A
SCHEMBL3815751 0.72 SMN1; SMN2 (0.72) LMNAMAPTHPGDKMT2ASMN1; SMN2
SCHEMBL8482180 0.72 LMNA (0.43) LMNAMAPTTP53THRBKMT2A
SCHEMBL7010262 0.71 KMT2A (0.59) LMNAMAPTTP53THRBHPGD

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-5945431-A VIRICIDE BIOCHEM THERAPEUTICS INCORPORATED (CA) 1999-08-31 US disclosed