SCHEMBL9434734

SCHEMBL9434734

NCC(=O)NC(=O)/C=C\C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
EGLN3 Q9H6Z9 1/20 0.43
GABRR1 P24046 2/20 0.42
GABRR2 P28476 2/20 0.42
BLM P54132 2/20 0.42
LMNA P02545 2/20 0.42
GABRR3 A8MPY1 1/20 0.42
APEX1 P27695 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
LPAR2 Q9HBW0 2/20 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
SCHEMBL9434744 1.00 TSHR (0.43) TSHRTP53EGLN1EGLN3GABRR1
SCHEMBL9397488 0.90 GLRA1 (0.35) TSHRGABRR1GABRR2BLMLMNA
SCHEMBL9227811 0.81 MAPT (0.37) LMNANPSR1ALDH1A1GAAHTT
SCHEMBL28103576 0.76 LMNA (0.31) TP53LMNAALDH1A1L3MBTL1
SCHEMBL989814 0.75 MAPT (0.50) TSHRTP53EGLN1EGLN3GABRR1
SCHEMBL989812 0.75 MAPT (0.50) TSHRTP53EGLN1EGLN3GABRR1
SCHEMBL989815 0.75 MAPT (0.50) TSHRTP53EGLN1EGLN3GABRR1
SCHEMBL28072502 0.74 GABRR1 (0.31) TSHRGABRR1GABRR2BLMLMNA
SCHEMBL8783208 0.74
SCHEMBL4141451 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116139334-B Strong-adhesion injectable hyaluronic acid double-network hydrogel and preparation method thereof 上海市同仁医院 2024-11-15 CN claimed
CN-116139334-A Strong-adhesion injectable hyaluronic acid double-network hydrogel and preparation method thereof 上海市同仁医院 2023-05-23 CN claimed
CN-104177558-A polycarboxylate-type water-reducer and preparation method thereof SHANDONG HONGYI TECHNOLOGY CO LTD 2014-12-03 CN claimed
CN-103011666-A Polycarboxylate-type cement water-reducing agent and preparation method thereof UNIV TAIYUAN TECHNOLOGY 2013-04-03 CN claimed
JP-6336474-A None JP disclosed
CN-116139334-B Strong-adhesion injectable hyaluronic acid double-network hydrogel and preparation method thereof 上海市同仁医院 2024-11-15 CN disclosed
CN-116139334-A Strong-adhesion injectable hyaluronic acid double-network hydrogel and preparation method thereof 上海市同仁医院 2023-05-23 CN disclosed
CN-104177558-A polycarboxylate-type water-reducer and preparation method thereof SHANDONG HONGYI TECHNOLOGY CO LTD 2014-12-03 CN disclosed
CN-102898598-B SO4<2->/ZrO2-Fe2O3-SiO2 doped mixed-crystal solid acid and preparation method thereof SHANDONG DONGSHENG NEW MAT CO 2014-06-18 CN disclosed
CN-103011666-A Polycarboxylate-type cement water-reducing agent and preparation method thereof UNIV TAIYUAN TECHNOLOGY 2013-04-03 CN disclosed
CN-102898598-A SO4<2->/ZrO2-Fe2O3-SiO2 doped mixed-crystal solid acid and preparation method thereof SHANDONG DONGSHENG NEW MAT CO 2013-01-30 CN disclosed
JP-H06336474-A FLUOROALKYL GROUP-CONTAINING MALEIMIDE DERIVATIVE NIPPON OIL & FATS CO LTD 1994-12-06 JP disclosed