SCHEMBL24566232

SCHEMBL24566232

CC(C)(C#N)c1cc(N=C=S)nn1[C@@H]1CCOC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
CNR2 P34972 2/20 0.32
CNR1 P21554 1/20 0.32
MAP3K12 Q12852 1/20 0.32

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
SCHEMBL24566258 1.00 BRD4 (0.36) BRD4CREBBPCNR2CNR1MAP3K12
SCHEMBL24007022 0.88 CNR2 (0.35) CNR2
SCHEMBL24007028 0.88 CNR2 (0.35) CNR2
SCHEMBL24566070 0.83 MAP3K12 (0.34) MAP3K12
SCHEMBL24565651 0.81 MAP3K12 (0.32) MAP3K12
SCHEMBL24566631 0.81 MAP3K12 (0.32) MAP3K12
SCHEMBL24007866 0.81 PDE4D (0.32)
SCHEMBL24816262 0.81 BRD4 (0.39) BRD4CREBBPCNR2CNR1MAP3K12
SCHEMBL24007247 0.80 BRD4 (0.39) BRD4CREBBPCNR2CNR1MAP3K12
SCHEMBL24007404 0.80 BRD4 (0.39) BRD4CREBBPCNR2CNR1MAP3K12

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
EP-4267574-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2023-11-01 EP disclosed
WO-2022140527-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
WO-2022140527-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed