SCHEMBL22907397

SCHEMBL22907397

CCC/C(N)=N\c1cc(F)c(F)cc1C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAD52 P43351 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL23964790 0.71 SIGMAR1 (0.49) MEN1KMT2A
SCHEMBL22219455 0.71 SIGMAR1 (0.33) MEN1KMT2ASMN1; SMN2
SCHEMBL18476216 0.69 KDM1A (0.35) ALDH1A1
SCHEMBL24292545 0.69 ESR1 (0.30) —
SCHEMBL23713679 0.62 HSP90AA1 (0.38) —
SCHEMBL12964083 0.62 LMNA (0.40) HTT
SCHEMBL20355351 0.62 — —
SCHEMBL22791405 0.62 SIGMAR1 (0.32) MEN1KMT2ASMN1; SMN2
SCHEMBL22791510 0.61 MEN1 (0.37) MEN1KMT2ASMN1; SMN2
SCHEMBL5616902 0.59 ACHE (0.42) ALDH1A1

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-2021011913-A1 TAU-PROTEIN TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2021-01-21 — — WO disclosed
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