SCHEMBL29230275

SCHEMBL29230275

S=C(NCc1ccccc1)N1CCCN(c2ncnc3[nH]ccc23)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 11/20 0.62
KIT P10721 2/20 0.58
PDGFRA P16234 1/20 0.58
JAK3 P52333 3/20 0.55
JAK2 O60674 1/20 0.52
JAK1 P23458 1/20 0.52
TYK2 P29597 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL30945086 1.00 PDGFRB (0.62) PDGFRBKITPDGFRAJAK3JAK2
SCHEMBL2912785 0.81 PDGFRB (0.78) PDGFRBKITPDGFRAMEN1KMT2A
SCHEMBL1029982 0.80 PDGFRB (0.61) PDGFRBKITPDGFRAMEN1KMT2A
SCHEMBL29230307 0.80 KIT (0.65) PDGFRBKITJAK3
SCHEMBL1049485 0.80 JAK3 (0.59) JAK3JAK2JAK1TYK2
SCHEMBL1045783 0.79 JAK3 (0.55) PDGFRBKITPDGFRAJAK3JAK2
SCHEMBL10316846 0.79 JAK3 (0.55) PDGFRBKITPDGFRAJAK3JAK2
SCHEMBL2924906 0.78 PDGFRB (0.93) PDGFRBKITPDGFRA
SCHEMBL7656072 0.78 PDGFRB (0.67) PDGFRBKITPDGFRAMEN1KMT2A
SCHEMBL29230424 0.78 HPGDS (0.53) PDGFRBJAK3JAK1MEN1KMT2A

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
CN-118146226-A Pyrrolo [2,3-d ] pyrimidine compound with nitrogen-containing heterocyclic structure, and preparation method and application thereof 贵州大学 2024-06-07 CN disclosed