SCHEMBL8918905

SCHEMBL8918905

CCOC(=O)c1cnc2c(c(-c3ccc(Cl)cc3)nn2C(C)(C)C)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.57
KDM4E B2RXH2 7/20 0.57
HPGD P15428 3/20 0.57
SMN1; SMN2 Q16637 5/20 0.54
ABL1 P00519 3/20 0.54
SRC P12931 3/20 0.54
CYP2C19 P33261 3/20 0.54
RIPK2 O43353 2/20 0.54
EGFR P00533 2/20 0.54
LCK P06239 2/20 0.54
FYN P06241 2/20 0.54
YES1 P07947 2/20 0.54
LYN P07948 2/20 0.54
PDGFRA P16234 2/20 0.54
PRKACA P17612 2/20 0.54
KDR P35968 2/20 0.54
FRK P42685 2/20 0.54
MAPK9 P45984 2/20 0.54
CSNK1A1 P48729 2/20 0.54
CSNK1D P48730 2/20 0.54

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
SCHEMBL3685595 0.92 KDM4E (0.54) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL8916363 0.90 KMT2A (0.54) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL8915718 0.89 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL3689010 0.83 KMT2A (0.54) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL13019702 0.82 SRC (0.55) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL3689655 0.80 KDM4E (0.49) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL3686400 0.78 SRC (0.58) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL13019701 0.76 KDR (0.55) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL8914578 0.74 SRC (0.60) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1
SCHEMBL3715216 0.74 SRC (0.67) ALDH1A1KDM4EHPGDSMN1; SMN2ABL1

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