SCHEMBL29779594

SCHEMBL29779594

O=C(NO)c1cnc(CN2CCc3ccccc3C2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 5/20 0.53
▸ HDAC1 Q13547 6/20 0.52
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ TNF P01375 2/20 0.47
▸ NOD2 Q9HC29 2/20 0.47
▸ NOD1 Q9Y239 2/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ HDAC3 O15379 2/20 0.46
▸ HDAC8 Q9BY41 2/20 0.46
▸ NCOR2 Q9Y618 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ABCB1 P08183 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL23167500 1.00 HDAC6 (0.53) HDAC6HDAC1MEN1KMT2ATNF
SCHEMBL30324527 0.83 HDAC1 (0.51) HDAC6HDAC1MEN1KMT2ATNF
SCHEMBL23202436 0.79 HDAC6 (0.77) HDAC6HDAC1HDAC3HDAC8HDAC4
SCHEMBL25138289 0.76 HDAC6 (0.47) HDAC6HDAC1HDAC3HDAC8HDAC4
SCHEMBL29228583 0.75 HDAC1 (0.87) HDAC6HDAC1MEN1KMT2ATNF
SCHEMBL30960755 0.75 HDAC1 (0.87) HDAC6HDAC1MEN1KMT2ATNF
SCHEMBL23202576 0.74 HDAC6 (0.43) HDAC6HDAC1HDAC3HDAC8HDAC4
SCHEMBL720087 0.74 HDAC6 (0.55) HDAC6HDAC1MEN1KMT2ARAB9A
SCHEMBL26050914 0.73 HDAC1 (0.56) HDAC6HDAC1HDAC3HDAC8SMN1; SMN2
SCHEMBL23202608 0.73 HDAC6 (0.66) HDAC6HDAC1HDAC3HDAC8NCOR2

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-4037670-A1 5-FLUORONICOTINAMIDE DERIVATIVES AND USES THEREOF Tenaya Therapeutics, Inc. (US) 2022-08-10 — — EP disclosed
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