SCHEMBL29199658

SCHEMBL29199658

CCOC(C)N(C(=O)C(=O)O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 3/20 0.40
TP53 P04637 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 2/20 0.38
GLA P06280 1/20 0.38
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
NPC1 O15118 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
Oxalic Acid SCHEMBL29203689 0.78 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL27690534 0.72 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL6028468 0.72 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL2572166 0.71 L3MBTL1 (0.40) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL1637983 0.70 L3MBTL1 (0.39) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL27614809 0.69 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL11671231 0.69 KMT2A (0.44) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL10472027 0.68 TP53 (0.38) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL7663163 0.68 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1TP53LMNATSHR
SCHEMBL9223060 0.65 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1TP53TSHRGLA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117956902-A Novel pesticide composition 拉吉夫·拉特霍德 2024-04-30 CN disclosed
CN-117915774-A Novel insecticidal compositions comprising elemental sulfur and Acynonapyr 希特逊库玛·阿尼凯特·多希 2024-04-19 CN disclosed
CN-117835820-A Novel pesticide composition 希特逊库玛·阿尼凯特·多希 2024-04-05 CN disclosed