SCHEMBL28098746

SCHEMBL28098746

C=CCNC(C)(C)CC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
FAAH O00519 1/20 0.32
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL19649555 0.72 DPP4 (0.31)
SCHEMBL35470 0.72 ALDH1A1 (0.51) TSHRALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL16915525 0.72 ALDH1A1 (0.51) TSHRALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL26434018 0.72 TSHR (0.39) TSHRSMN1; SMN2MAPTALDH1A1FAAH
SCHEMBL19494993 0.72 ALDH1A1 (0.33) TSHRSMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL8476281 0.71 KDM4E (0.37) SMN1; SMN2ALDH1A1KMT2AMAPK1
Hydrochloric Acid SCHEMBL5964776 0.71 ALDH1A1 (0.38) TSHRALDH1A1KMT2A
SCHEMBL8475429 0.71 KDM4E (0.32) MAPK1
Ethylene SCHEMBL28248632 0.71 ALDH1A1 (0.50) TSHRALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL28185312 0.71 ALDH1A1 (0.50) TSHRALDH1A1CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112920559-B Antibacterial high-strength biodegradable plastic bag and preparation method thereof 余姚市康乐彩印包装有限公司 2022-03-29 CN claimed
CN-112920559-A Antibacterial high-strength biodegradable plastic bag and preparation method thereof 余姚市康乐彩印包装有限公司 2021-06-08 CN claimed
CN-112920559-B Antibacterial high-strength biodegradable plastic bag and preparation method thereof 余姚市康乐彩印包装有限公司 2022-03-29 CN disclosed
CN-112920559-A Antibacterial high-strength biodegradable plastic bag and preparation method thereof 余姚市康乐彩印包装有限公司 2021-06-08 CN disclosed
CN-105979973-B Non- self-adhesive coating material 罗塞尔工业公司 2019-08-23 CN disclosed
CN-105979973-A NON-SELF-ADHERENT COATING MATERIALS 罗塞尔工业公司 2016-09-28 CN disclosed