SCHEMBL24747200

SCHEMBL24747200

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

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
HPGD P15428 5/20 0.56
LMNA P02545 2/20 0.56
TSHR P16473 1/20 0.56
GAA P10253 2/20 0.52
ALDH1A1 P00352 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CPS1 P31327 2/20 0.49
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
HTT P42858 1/20 0.47
NPC1 O15118 1/20 0.45
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
SCHEMBL30630172 1.00 MEN1 (0.64) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24747199 0.85 SMN1; SMN2 (0.51) MEN1KMT2AHPGDTSHRGAA
SCHEMBL24745778 0.83 MEN1 (0.64) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24163473 0.81 MEN1 (0.73) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24745777 0.80 MEN1 (0.63) MEN1KMT2AHPGDLMNATSHR
SCHEMBL30630165 0.80 HPGD (0.56) MEN1KMT2AHPGDLMNATSHR
SCHEMBL24747198 0.80 HPGD (0.56) MEN1KMT2AHPGDLMNATSHR
SCHEMBL19667102 0.77 LCK (0.65) HPGDLMNATSHRALDH1A1NPSR1
SCHEMBL2105339 0.77 HPGD (0.74) MEN1KMT2AHPGDLMNATSHR
SCHEMBL3308874 0.76 LCK (0.49) HPGDLMNATSHRALDH1A1NPSR1

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