SCHEMBL4756582

SCHEMBL4756582

CCCCN(C)c1cccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
LMNA P02545 4/20 0.39
HTT P42858 3/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC3 O15379 1/20 0.38
ALDH1A1 P00352 3/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RECQL P46063 1/20 0.35
HPGD P15428 1/20 0.35
ESR2 Q92731 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
GLA P06280 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL4757636 0.94 HDAC1 (0.39) KMT2ALMNAHTTMAPTPOLB
SCHEMBL325229 0.84 KMT2A (0.38) KMT2ALMNAHTTMAPTPOLB
SCHEMBL84309 0.82 KMT2A (0.38) KMT2ALMNAHTTMAPTPOLB
SCHEMBL8544254 0.79
SCHEMBL6642474 0.79 KMT2A (0.36) KMT2ALMNAHTTMAPTPOLB
SCHEMBL28289191 0.78 TAAR1 (0.41) KMT2ALMNAPOLBSMN1; SMN2ALDH1A1
SCHEMBL13206634 0.78 TDP1 (0.44) KMT2ALMNAMAPTPOLBALDH1A1
SCHEMBL5888976 0.77 HDAC1 (0.36) KMT2ALMNAHTTMAPTPOLB
Hydrochloric Acid SCHEMBL11064048 0.74 TAAR1 (0.46) KMT2ALMNAHTTNPSR1SMN1; SMN2
SCHEMBL9420129 0.74 KMT2A (0.41) KMT2ALMNAHTTMAPTPOLB

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
WO-2008126684-A2 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-23 WO disclosed