SCHEMBL29459335

SCHEMBL29459335

Cc1ccc(C(c2ccccc2)=[Hf](c2cccc3c2Cc2ccccc2-3)C2C=CC=C2)s1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL29459181 0.87 NPC1 (0.36) NPC1RAB9A
SCHEMBL29775014 0.85 PNMT (0.37) NPC1RAB9A
SCHEMBL29459308 0.84
SCHEMBL29700345 0.81 HTR7 (0.33) NPC1RAB9A
SCHEMBL29459218 0.81 PNMT (0.30) NPC1RAB9A
SCHEMBL29459211 0.80 NPC1 (0.41) NPC1RAB9A
SCHEMBL29976071 0.76 NPC1 (0.34) NPC1RAB9A
SCHEMBL29700197 0.76 PNMT (0.36) NPC1RAB9A
SCHEMBL29459327 0.76 NPC1 (0.43) NPC1RAB9A
SCHEMBL29977494 0.74 PNMT (0.33) NPC1RAB9A

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
EP-3953403-A1 CATALYST SYSTEM Borealis AG (AT) 2022-02-16 EP disclosed