SCHEMBL28101007

SCHEMBL28101007

CC(C)OC=O.COC1(OC)CC(CO)C1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 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
SCHEMBL28269462 0.83 APLNR (0.57) APLNR
SCHEMBL1863100 0.80 APLNR (0.46) APLNR
SCHEMBL28318062 0.78
SCHEMBL28100920 0.76
SCHEMBL27908928 0.72 GABRA5 (0.35)
Alcohol SCHEMBL27824847 0.69
SCHEMBL30154499 0.66 TDP1 (0.30)
SCHEMBL9293 0.66
SCHEMBL52124 0.65 APLNR (0.34) APLNR
SCHEMBL30843655 0.65 APLNR (0.39) APLNR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105916855-B Substituted 4, 5, 6, 7-tetrahydropyrazolo [1,5-a ] pyrazine derivatives as casein kinase 1D/E inhibitors 百时美施贵宝公司 2019-03-15 CN disclosed
CN-105916855-A Substituted 4,5,6, 7-tetrahydropyrazolo [1,5-a ] pyrazine derivatives as casein kinase 1D/E inhibitors 百时美施贵宝公司 2016-08-31 CN disclosed