SCHEMBL24745778

SCHEMBL24745778

COc1cc(N)c(F)cc1C(=O)N1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
HPGD P15428 4/20 0.53
LMNA P02545 1/20 0.53
TSHR P16473 1/20 0.53
GAA P10253 1/20 0.52
ACHE P22303 1/20 0.51
HTR4 Q13639 1/20 0.51
CPS1 P31327 2/20 0.49
POLB P06746 1/20 0.48
HTT P42858 1/20 0.47
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL15651833 0.88 KDM4E (0.58) MEN1KMT2ATSHRGAAPOLB
SCHEMBL30630172 0.83 MEN1 (0.64) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24747200 0.83 MEN1 (0.64) MEN1KMT2AHPGDLMNATSHR
SCHEMBL15651401 0.82 HPGD (0.47) MEN1KMT2AHPGDLMNATSHR
SCHEMBL15652199 0.82 MEN1 (0.66) MEN1KMT2AGAAHTR4ALDH1A1
SCHEMBL17076761 0.82 ACHE (0.47) MEN1KMT2AHPGDLMNAGAA
SCHEMBL15651429 0.82 MEN1 (0.62) MEN1KMT2AHPGDLMNATSHR
SCHEMBL15651106 0.82 ACHE (0.47) MEN1KMT2AHPGDLMNAGAA
SCHEMBL15651416 0.80 MEN1 (0.63) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24745777 0.80 MEN1 (0.63) MEN1KMT2AHPGDLMNATSHR

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-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed