SCHEMBL30391810

SCHEMBL30391810

O=C(OC1CCc2[nH]ncc21)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 2/20 0.50
▸ KDR P35968 2/20 0.50
▸ CDK8 P49336 2/20 0.50
▸ CDK9 P50750 2/20 0.50
▸ ROCK1 Q13464 2/20 0.50
▸ CLK4 Q9HAZ1 2/20 0.50
▸ DYRK1B Q9Y463 2/20 0.50
▸ PDGFRA P16234 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CHRNA7 P36544 3/20 0.43
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DAPK3 O43293 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ CSF1R P07333 1/20 0.39
▸ RET P07949 1/20 0.39
▸ LTK P29376 1/20 0.39
▸ GRK5 P34947 1/20 0.39

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
SCHEMBL30392549 0.92 PRKACA (0.45) PRKACAKDRCDK8CDK9ROCK1
SCHEMBL25520813 0.76 PDGFRA (0.39) PRKACAKDRCDK8CDK9ROCK1
SCHEMBL26135594 0.74 ALDH1A1 (0.44) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL8558598 0.74 IDO1 (0.53) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL9722001 0.69 IDO1 (0.55) ALDH1A1LMNACHRNA7MEN1KMT2A
SCHEMBL19014758 0.67 LMNA (0.48) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL29014606 0.67 ALDH1A1 (0.47) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL19014677 0.67 LMNA (0.48) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL21840899 0.67 TRPM8 (0.49) ALDH1A1LMNACHRNA7GAAMEN1
SCHEMBL19014832 0.67 LMNA (0.48) ALDH1A1LMNACHRNA7GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4423069-A1 INHIBITORS OF HIF-2ALPHA AND METHODS OF USE THEREOF Arcus Biosciences, Inc. (US) 2024-09-04 — — EP disclosed
WO-2023077046-A1 INHIBITORS OF HIF-2ALPHA AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2023-05-04 — — WO disclosed
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