SCHEMBL29547728

SCHEMBL29547728

Cn1c2cc(-c3ccc(F)nc3)ccc2c2cncc(F)c21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
CYP11B2 P19099 2/20 0.38
CYP11B1 P15538 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PDE10A Q9Y233 7/20 0.37
PDE2A O00408 5/20 0.37
PDE5A O76074 4/20 0.37
LIMK1 P53667 2/20 0.37
GRIN1 Q05586 5/20 0.37
GRIN2B Q13224 5/20 0.37
ATM Q13315 1/20 0.35
PDE11A Q9HCR9 3/20 0.35

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
SCHEMBL20128587 1.00 MAPT (0.39) MAPTCYP11B2CYP11B1NPC1POLB
SCHEMBL20128572 0.88 LIMK1 (0.39) NPC1POLBGAARAB9ARXFP1
SCHEMBL20129215 0.87 CYP11B2 (0.44) MAPTCYP11B2CYP11B1NPC1POLB
SCHEMBL20128561 0.84 METAP2 (0.42) CYP11B2CYP11B1
SCHEMBL14134198 0.80 MAPT (0.48) MAPTCYP11B2NPC1POLBGAA
SCHEMBL29547590 0.80 MAPT (0.48) MAPTCYP11B2NPC1POLBGAA
SCHEMBL27097921 0.77 EGLN1 (0.34) MAPTNPC1RAB9ARXFP1
SCHEMBL29547669 0.77 EGLN1 (0.34) MAPTNPC1RAB9ARXFP1
SCHEMBL22906811 0.71 GRIN1 (0.36) GRIN1GRIN2B
SCHEMBL20128576 0.70 MAPT (0.47) MAPTNPC1POLBGAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954801-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-05-09 CN disclosed
CN-114867727-B TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-02-21 CN disclosed
CN-114867727-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2022-08-05 CN disclosed
EP-3999182-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2022-05-25 EP disclosed