SCHEMBL26699650

SCHEMBL26699650

O=c1ccc(-c2ccc(N3CC[CH]CC3)c(C(F)(F)F)c2)n[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 7/20 0.51
▸ PDE3B Q13370 8/20 0.44
▸ PDE3A Q14432 8/20 0.44
▸ KDR P35968 1/20 0.43
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ JAK2 O60674 1/20 0.39
▸ NTRK1 P04629 1/20 0.39
▸ RET P07949 1/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ CDK8 P49336 1/20 0.39
▸ NTRK3 Q16288 1/20 0.39
▸ NTRK2 Q16620 1/20 0.39
▸ AURKB Q96GD4 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38

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
SCHEMBL13071051 0.90 NOTUM (0.62) NOTUMPDE3BPDE3AKDRPDE4A
SCHEMBL13071050 0.89 NOTUM (0.61) NOTUMPDE3BPDE3AKDRPDE4A
SCHEMBL1769796 0.89 NOTUM (0.61) NOTUMPDE3BPDE3AKDRPDE4A
SCHEMBL12649035 0.88 NOTUM (0.51) NOTUMPDE3BPDE3AKDRPDE4A
SCHEMBL13071350 0.88 NOTUM (0.54) NOTUMPDE3BPDE3AKDR
SCHEMBL12648793 0.87 NOTUM (0.65) NOTUMPDE3BPDE3AKDRAURKB
SCHEMBL1769904 0.87 PDE3B (0.55) NOTUMPDE3BPDE3A
SCHEMBL1769918 0.86 PDE3B (0.59) NOTUMPDE3BPDE3AKDRMEN1
SCHEMBL25698377 0.83 NOTUM (0.47) NOTUMPDE3BPDE3AKDR
SCHEMBL12648799 0.83 NOTUM (0.47) NOTUMPDE3BPDE3AKDR

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
WO-2023226950-A1 PEPTIDOMIMETIC STAT PROTEIN DEGRADER, COMPOSITION AND USE THEREOF 杭州和正医药有限公司 2023-11-30 — — WO disclosed
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