SCHEMBL20052966

SCHEMBL20052966

CCCCNC(=S)NCCC(C)(C)N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
SMN1; SMN2 Q16637 7/20 0.41
HTT P42858 4/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 4/20 0.40
GAA P10253 3/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
ALOX12 P18054 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
TDP1 Q9NUW8 2/20 0.37
EPHX2 P34913 1/20 0.37
MMP2 P08253 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL2019755 0.88 ALDH1A1 (0.38) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL17219 0.81 KMT2A (0.57) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL14860830 0.77 KMT2A (0.53) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL10948478 0.75 MEN1 (0.48) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL5655081 0.74 ALDH1A1 (0.65) KMT2AMEN1SMN1; SMN2HTTLMNA
SCHEMBL11594862 0.74 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAEPHX2
SCHEMBL11141423 0.74 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAEPHX2
SCHEMBL11596181 0.74 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAEPHX2
SCHEMBL11053795 0.74 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAEPHX2
SCHEMBL11596632 0.74 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAEPHX2

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-9944770-B2 Moisture curable compound with thiourea MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2018-04-17 US disclosed