SCHEMBL7302490

SCHEMBL7302490

CCn1nc(C)c(C#N)c1N

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.41
MAPT P10636 7/20 0.39
ADORA2A P29274 2/20 0.36
ADORA2B P29275 2/20 0.36
KDM5A P29375 1/20 0.35
POLB P06746 2/20 0.35
PIK3CG P48736 1/20 0.34
HTT P42858 2/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP11B2 P19099 1/20 0.33

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
SCHEMBL7352542 0.85 TSHR (0.56) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL11545681 0.82 TSHR (0.41) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL2200208 0.82 TSHR (0.54) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL8552268 0.80 TSHR (0.55) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL7305763 0.80 TSHR (0.55) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL13861497 0.80 TSHR (0.42) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL16654865 0.79 TSHR (0.40) TSHRALDH1A1GAAMAPT
SCHEMBL31194577 0.79 GAA (0.54) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL8552869 0.78 TSHR (0.52) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL8553278 0.78 TSHR (0.52) TSHRMEN1KMT2ALMNAALDH1A1

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-4719385-A2 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINES AS ANTI-INFECTIOUS AGENTS University of Vermont and State Agricultural College (US) 2026-04-08 EP disclosed
WO-2024249380-A2 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINES AS ANTI-INFECTIOUS AGENTS UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2024-12-05 WO disclosed
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed
EP-0636626-A1 Pyrazolopyrimidine Derivatives LABORATOIRES GLAXO SA (FR) 1995-02-01 EP disclosed