SCHEMBL29740323

SCHEMBL29740323

CN(C)c1cc(C(=O)O)nc(N(C)C)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.46
ALOX15 P16050 3/20 0.42
TSHR P16473 3/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.40
NAPEPLD Q6IQ20 1/20 0.39
APAF1 O14727 1/20 0.38
NSD2 O96028 1/20 0.38
MAPT P10636 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
UBA2 Q9UBT2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 3/20 0.37

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
SCHEMBL3404588 1.00 CTSA (0.46) CTSAALOX15TSHRHIF1AKDM4E
SCHEMBL13692143 0.85 CTSA (0.43) CTSAALOX15TSHRKDM4EALDH1A1
SCHEMBL1179404 0.81 HPGD (0.43) ALOX15TSHRHIF1AKDM4EALDH1A1
SCHEMBL13689297 0.80 CTSA (0.43) CTSAALOX15TSHRKDM4EALDH1A1
SCHEMBL1179269 0.77 HCAR2 (0.39) CTSAALOX15TSHRHIF1AKDM4E
SCHEMBL18036147 0.77 TDP1 (0.62) ALOX15TSHRHIF1AKDM4EALDH1A1
SCHEMBL4265950 0.76 LMNA (0.56) TSHRKDM4EALDH1A1HSD17B10APAF1
SCHEMBL1178845 0.74 KDM4E (0.43) ALOX15TSHRHIF1AKDM4EALDH1A1
SCHEMBL13779959 0.73 KDM4C (0.46) TSHRKDM4EALDH1A1HPGDPOLB
SCHEMBL1180248 0.73 NOS3 (0.36) CTSAALOX15TSHRHIF1AKDM4E

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-116102700-B Softening agent and preparation method thereof 江苏奥斯佳材料科技股份有限公司 2024-12-10 CN claimed
CN-116285775-A High-performance chloroprene rubber adhesive and preparation method thereof 上谷新材料(苏州)有限公司 2023-06-23 CN claimed
CN-116102700-A Softening agent and preparation method thereof 江苏奥斯佳材料科技股份有限公司 2023-05-12 CN claimed
CN-112961303-B Softening agent for soft polyurethane foam and application thereof 江苏奥斯佳材料科技股份有限公司 2023-01-03 CN claimed
CN-119505154-A Special cross-linking agent for flexible polyurethane foam and application thereof 奥斯佳新材料技术研究(江苏)有限公司 2025-02-25 CN disclosed
CN-116120515-B Flexible polyurethane foam and method for producing the same 江苏奥斯佳材料科技股份有限公司 2024-12-10 CN disclosed
CN-116102700-B Softening agent and preparation method thereof 江苏奥斯佳材料科技股份有限公司 2024-12-10 CN disclosed
CN-116285775-A High-performance chloroprene rubber adhesive and preparation method thereof 上谷新材料(苏州)有限公司 2023-06-23 CN disclosed
CN-116120515-A Flexible polyurethane foam and method for producing the same 江苏奥斯佳材料科技股份有限公司 2023-05-16 CN disclosed
CN-116102700-A Softening agent and preparation method thereof 江苏奥斯佳材料科技股份有限公司 2023-05-12 CN disclosed
CN-112961303-B Softening agent for soft polyurethane foam and application thereof 江苏奥斯佳材料科技股份有限公司 2023-01-03 CN disclosed
CN-109206580-B Hybrid cross-linked dynamic polymer 厦门天策材料科技有限公司 2022-08-02 CN disclosed