SCHEMBL28949385

SCHEMBL28949385

c1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3ccccc23)cc1.c1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3ccccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
HIF1A Q16665 1/20 0.51
AKT1 P31749 1/20 0.49
GSK3B P49841 2/20 0.45
KMT2A Q03164 1/20 0.44

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
SCHEMBL44765 1.00 SMN1; SMN2 (0.51) SMN1; SMN2HIF1AAKT1GSK3BKMT2A
SCHEMBL29349692 1.00 SMN1; SMN2 (0.51) SMN1; SMN2HIF1AAKT1GSK3BKMT2A
SCHEMBL16249154 0.92 THRB (0.47) SMN1; SMN2HIF1AAKT1
SCHEMBL16241067 0.91 TSHR (0.49) SMN1; SMN2HIF1AAKT1GSK3BKMT2A
SCHEMBL19289688 0.91 TSHR (0.47) SMN1; SMN2HIF1AAKT1KMT2A
SCHEMBL26230390 0.90 AVPR1A (0.56)
SCHEMBL4544649 0.89 SMN1; SMN2 (0.42) SMN1; SMN2HIF1AAKT1GSK3B
SCHEMBL12593290 0.88 AKT1 (0.46) AKT1GSK3B
SCHEMBL766101 0.88 SMN1; SMN2 (0.43) SMN1; SMN2HIF1AAKT1
SCHEMBL16249161 0.88 AKT1 (0.54) SMN1; SMN2HIF1AAKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116323602-A High refractive index benzopyrrole derivative and organic electroluminescent element comprising same 株式会社乐普拓 2023-06-23 CN disclosed
CN-115697977-A Benzopyrrole derivative and organic electroluminescent element comprising same 株式会社乐普拓 2023-02-03 CN disclosed
CN-115667232-A Benzopyrrole derivative and organic electroluminescent element comprising same 株式会社乐普拓 2023-01-31 CN disclosed