SCHEMBL29779602

SCHEMBL29779602

O=C(NO)c1cnc(CN2C(=O)COc3ccccc32)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.46
▸ GAA P10253 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CBX7 O95931 2/20 0.44
▸ CDYL2 Q8N8U2 2/20 0.44
▸ CDYL Q9Y232 2/20 0.44
▸ CDY1; CDY1B Q9Y6F8 2/20 0.44
▸ TSHR P16473 3/20 0.44
▸ USP2 O75604 1/20 0.44
▸ GRM5 P41594 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ HDAC5 Q9UQL6 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ POLB P06746 1/20 0.42

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
SCHEMBL23166446 1.00 CHRM1 (0.49) CHRM1ALDH1A1GAAKDM4EMAPT
SCHEMBL25138325 0.81 HDAC6 (0.54) ALDH1A1MAPTTSHRGRM5HDAC1
SCHEMBL23202576 0.77 HDAC6 (0.43) CHRM1HDAC1HDAC8HDAC6HDAC5
SCHEMBL18581560 0.74 KDM4E (0.50) CHRM1ALDH1A1KDM4EMAPTTSHR
SCHEMBL29790608 0.71 BRD4 (0.55) ALDH1A1KDM4EMAPTCBX7CDYL2
SCHEMBL18581748 0.71 BRD4 (0.55) ALDH1A1KDM4EMAPTCBX7CDYL2
SCHEMBL18581471 0.71 CBX7 (0.46) ALDH1A1KDM4EMAPTCBX7CDYL2
SCHEMBL29790714 0.71 CBX7 (0.46) ALDH1A1KDM4EMAPTCBX7CDYL2
SCHEMBL23201987 0.71 HDAC6 (0.45) ALDH1A1HDAC1HDAC8HDAC6HDAC5
SCHEMBL18581373 0.71 ALDH1A1 (0.58) ALDH1A1KDM4EMAPTHDAC1HDAC8

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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