SCHEMBL29636596

SCHEMBL29636596

CCOC(=O)C(=C(C)N)c1cccc(OC)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PLIN1 O60240 1/20 0.46
POLB P06746 1/20 0.46
PLIN5 Q00G26 1/20 0.46
ABHD5 Q8WTS1 1/20 0.46
GAA P10253 1/20 0.41
CYP19A1 P11511 1/20 0.41
KAT6A Q92794 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
CTSD P07339 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL1643613 1.00 LMNA (0.46) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL29362469 1.00 LMNA (0.46) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL1644169 0.82 KMT2A (0.51) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL29665865 0.82 KMT2A (0.51) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL28701340 0.82 KAT6A (0.47) LMNAPOLBGAAKAT6ACTSD
SCHEMBL28295204 0.82 KAT6A (0.47) LMNAPOLBGAAKAT6ACTSD
SCHEMBL27585725 0.79 TSHR (0.58) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL28927886 0.78 KMT2A (0.51) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL28766154 0.78 KMT2A (0.51) LMNAMAPTMEN1KMT2APLIN1
SCHEMBL1642002 0.77 CYP19A1 (0.41) LMNAMAPTMEN1KMT2APLIN1

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-109734616-B Method for synthesizing (Z) -3-amino-2- (2-fluoro-3-methoxyphenyl) -2-ethyl crotonate by two-step method 安徽诺全药业有限公司 2022-05-13 CN disclosed