SCHEMBL5275461

SCHEMBL5275461

CC(C)(C)n1ncc(N=O)c1N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL19356550 0.73 SMN1; SMN2 (0.44) HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL11316496 0.72 ALDH1A1 (0.33) —
SCHEMBL17045700 0.71 TSHR (0.39) HPGDSMN1; SMN2
SCHEMBL4163656 0.71 NOS3 (0.33) HPGDSMN1; SMN2
SCHEMBL25138723 0.69 HPGD (0.33) HPGDSMN1; SMN2
SCHEMBL19676493 0.69 — —
SCHEMBL5654731 0.69 RET (0.30) —
SCHEMBL7312168 0.68 RIPK2 (0.47) SMN1; SMN2
SCHEMBL15198091 0.67 POLB (0.41) —
Hydrochloric Acid SCHEMBL6760437 0.67 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408025-B1 3,3-DIALKOXY-2-HYDROXYIMINOPROPIONITRILES, PROCESS FOR PREPARATION THEREOF AND PROCESS OF PREPARING 5-AMINO -4-NITROSOPYRAZOLES OR SALTS THEREOF BY THE USE OF THE SAME UBE INDUSTRIES (JP) 2007-11-21 — — EP disclosed
US-7227032-B2 3,3-dialkoxy-2-hydroxyiminopropionitriles, process for preparation thereof and process of preparing 5-amino-4-nitrosopyrazoles or salts thereof by the use of the same UBE INDUSTRIES, LTD. (JP) 2007-06-05 — — US disclosed
US-20040116732-A1 3,3-Dialkoxy-2-hydroxyiminopropionitriles, process for preparation thereof and process of preparing 5-amino-4-nitrosopyrazoles or salts thereof by the use of the same UBE INDUSTRIES, LTD. (JP) 2004-06-17 — — US disclosed
EP-1408025-A1 3,3-DIALKOXY-2-HYDROXYIMINOPROPIONITRILES, PROCESS FOR PREPARATION THEREOF AND PROCESS OF PREPARING 5-AMINO -4-NITROSOPYRAZOLES OR SALTS THEREOF BY THE USE OF THE SAME Ube Industries, Ltd. (JP) 2004-04-14 — — EP disclosed
Send feedback