SCHEMBL29355779

SCHEMBL29355779

CC(O)C(C)c1ncc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CYP2C9 P11712 2/20 0.39
TSHR P16473 1/20 0.39
APEX1 P27695 1/20 0.39
PLAU P00749 1/20 0.38
MAPK1 P28482 2/20 0.38
KMT2A Q03164 4/20 0.35
IDH1 O75874 1/20 0.34
MEN1 O00255 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL22530398 1.00 LMNA (0.39) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL31518746 0.84 LMNA (0.41) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL2609312 0.79 LMNA (0.44) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL18244479 0.78 LMNA (0.42) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL6030679 0.76 LMNA (0.44) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL16044116 0.76 LMNA (0.44) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL16043880 0.76 LMNA (0.44) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL22530887 0.74 KMT2A (0.46) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL29355151 0.74 KMT2A (0.46) LMNASMN1; SMN2CYP2C9TSHRAPEX1
SCHEMBL22320215 0.73 SMN1; SMN2 (0.39) LMNASMN1; SMN2CYP2C9TSHRAPEX1

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
CN-113966171-A Fungicidal compositions 先正达农作物保护股份公司 2022-01-21 CN disclosed