SCHEMBL30608338

SCHEMBL30608338

O=c1[nH]cc(NCCO)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ TAAR1 Q96RJ0 1/20 0.59
▸ LMNA P02545 2/20 0.56
▸ GAA P10253 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ CYP3A4 P08684 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ BRD4 O60885 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ DPYD Q12882 1/20 0.39
▸ ATAD2 Q6PL18 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ MTOR P42345 1/20 0.39

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
SCHEMBL23133109 0.79 KDM4E (0.56) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL31045646 0.77 CYP3A4 (0.56) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL21184262 0.77 MAPT (0.54) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL4961428 0.76 LMNA (0.54) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL31506926 0.76 KDM4E (0.54) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL31065716 0.75 MEN1 (1.00) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL23133247 0.75 MEN1 (0.52) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL668116 0.73 CYP3A4 (0.51) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL1518339 0.73 MAPT (0.50) MAPTMEN1KMT2AKDM4ETAAR1
SCHEMBL16561955 0.71 PNP (0.52) MAPTLMNAGAA

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-116874724-A Polyurethane with gate-controlled switch and preparation method thereof, and composite coating prepared from polyurethane and preparation method thereof 中国科学院兰州化学物理研究所 2023-10-13 — — CN claimed
CN-116874724-A Polyurethane with gate-controlled switch and preparation method thereof, and composite coating prepared from polyurethane and preparation method thereof 中国科学院兰州化学物理研究所 2023-10-13 — — CN disclosed
CN-116874724-A Polyurethane with gate-controlled switch and preparation method thereof, and composite coating prepared from polyurethane and preparation method thereof 中国科学院兰州化学物理研究所 2023-10-13 — — CN disclosed
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