SCHEMBL28907607

SCHEMBL28907607

NC(=O)c1cocn1.O=C(NC1CC1)c1cn[nH]c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 10/20 0.39
CD38 P28907 1/20 0.38
BMPR1B O00238 1/20 0.36
BMPR1A P36894 1/20 0.36
TGFBR1 P36897 1/20 0.36
ACVRL1 P37023 1/20 0.36
ACVR1 Q04771 1/20 0.36
SYK P43405 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CFTR P13569 1/20 0.36
FAAH O00519 1/20 0.35
ROCK2 O75116 2/20 0.35
ROCK1 Q13464 2/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL1609860 0.80 CD38 (0.47) SMYD3CD38SMN1; SMN2L3MBTL1FAAH
SCHEMBL4886377 0.74 SMN1; SMN2 (0.51) SMN1; SMN2L3MBTL1ROCK2
SCHEMBL11898543 0.74 HPGDS (0.48) TGFBR1ROCK2ROCK1
SCHEMBL20387472 0.72 SMYD3 (0.54) SMYD3
SCHEMBL623172 0.71
Hydrochloric Acid SCHEMBL17204650 0.69
Hydrochloric Acid SCHEMBL17204496 0.69 ADORA3 (0.39)
Hydrochloric Acid SCHEMBL17205315 0.69 ADORA3 (0.39)
SCHEMBL23022275 0.69 HPGDS (0.51) ROCK2ROCK1
SCHEMBL6247409 0.69 ALDH1A1 (0.64) SMYD3SMN1; SMN2L3MBTL1HSD11B1

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-115885985-A Aqueous suspension concentrates FMC公司 2023-04-04 CN disclosed
CN-111225565-B Aqueous suspension concentrates FMC公司 2023-01-31 CN disclosed
CN-111970929-B Active ingredient combinations having insecticidal, nematicidal and acaricidal properties 拜耳公司 2022-12-06 CN disclosed