SCHEMBL8914855

SCHEMBL8914855

CC(C)(C)c1nn(C(C)(C)C)c(N)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL3715950 0.79 KMT2A (0.41) HPGDSMN1; SMN2GAATSHR
SCHEMBL12636857 0.79 MEN1 (0.30)
SCHEMBL3721267 0.75 KMT2A (0.36) HPGDSMN1; SMN2
SCHEMBL7315465 0.75 GAA (0.51) HPGDSMN1; SMN2GAATSHR
SCHEMBL24133460 0.70 RIPK2 (0.39) HPGDSMN1; SMN2
SCHEMBL2743087 0.70 GAA (0.61) HPGDSMN1; SMN2GAATSHR
SCHEMBL2743085 0.70 GAA (0.38) HPGDSMN1; SMN2GAATSHR
Hydrochloric Acid SCHEMBL7310497 0.69 CTSK (0.36) HPGD
SCHEMBL8308145 0.69 HPGD (0.49) HPGDSMN1; SMN2GAA
SCHEMBL21806810 0.68 ADORA1 (0.38) HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5593997-A 4-aminopyrazolo(3-,4-D)pyrimidine and 4-aminopyrazolo-(3,4-D)pyridine tyrosine kinase inhibitors PFIZER INC. (US) 1997-01-14 US disclosed