SCHEMBL27679283

SCHEMBL27679283

CCCC=C(C#N)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.40
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
POLB P06746 1/20 0.36
APP P05067 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 6/20 0.35
ALDH1A1 P00352 8/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
KMT2A Q03164 2/20 0.34
TNNI3 P19429 1/20 0.34
CRHBP P24387 1/20 0.34
TNNT2 P45379 1/20 0.34
KLK7 P49862 1/20 0.34
TNNC1 P63316 1/20 0.34

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
SCHEMBL17859724 1.00 CYP2C9 (0.40) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL5560343 0.89 KDM4E (0.38) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL3248980 0.87 EP300 (0.42) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL3248973 0.87 EP300 (0.42) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL27647414 0.86 EP300 (0.44) CYP2C9POLBSMN1; SMN2MAPTLMNA
SCHEMBL19573442 0.86 EP300 (0.44) CYP2C9POLBSMN1; SMN2MAPTLMNA
SCHEMBL666832 0.85 CYP2C9 (0.38) CYP2C9POLBSMN1; SMN2NPSR1NPC1
SCHEMBL2671871 0.84 CYP2C9 (0.42) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL10167752 0.84 CYP2C9 (0.42) CYP2C9ADORA2AADORA2BADORA1POLB
SCHEMBL8569025 0.83 CYP2C9 (0.59) CYP2C9POLBSMN1; SMN2NPSR1NPC1

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-115160233-A Self-adaptive deformation elastomer electrolyte, electrode and battery 陈本 2022-10-11 CN claimed
CN-1929799-B Method and apparatus for occlusion of a conduit FEMASYS INC 2011-04-13 CN disclosed
CN-1929799-A Method and apparatus for occlusion of a conduit FEMASYS INC (US) 2007-03-14 CN disclosed