SCHEMBL31662834

SCHEMBL31662834

O=Cc1ccc(-c2cnn(-c3ccc(OC(F)F)cc3)c2)cc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.41
MAPKAPK2 P49137 1/20 0.39
KCNH2 Q12809 10/20 0.37
GRIN2B Q13224 6/20 0.37

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
SCHEMBL31662997 0.91 POLB (0.39) KCNH2GRIN2B
SCHEMBL31663008 0.80 DRD1 (0.41) DRD1
SCHEMBL31663309 0.74 GRIN2B (0.36) KCNH2GRIN2B
SCHEMBL2710846 0.74 MAPKAPK2 (0.56) MAPKAPK2
SCHEMBL2712001 0.73 MEN1 (0.56) MAPKAPK2KCNH2
SCHEMBL31663007 0.73 MEN1 (0.42) DRD1MAPKAPK2
SCHEMBL11260550 0.72 ALDH1A1 (0.50) DRD1
SCHEMBL31662797 0.72 DYRK1A (0.49) KCNH2
SCHEMBL31663033 0.72 KCNH2 (0.55) KCNH2GRIN2B
SCHEMBL31662976 0.70 POLB (0.39) DRD1GRIN2B

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-2025149498-A1 BENZYLPIPERIDINE DERIVATIVES AS TRP4 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES ASTRAZENECA AB (SE) 2025-07-17 WO disclosed