SCHEMBL28616072

SCHEMBL28616072

Cc1c(Br)cccc1C(=O)NNC(=O)CCl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.46
KMT2A Q03164 2/20 0.43
NPC1 O15118 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 8/20 0.43
HTT P42858 4/20 0.42
GAA P10253 2/20 0.42
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 2/20 0.40
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL30577136 1.00 SMN1; SMN2 (0.46) SMN1; SMN2KMT2ANPC1MEN1ALDH1A1
SCHEMBL20539950 0.83 L3MBTL1 (0.46) SMN1; SMN2ALDH1A1GAAMAPTHPGD
SCHEMBL28921340 0.80 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL18729343 0.80 MAPT (0.47) ALDH1A1HTTGAARAB9AMAPT
SCHEMBL30395214 0.80 MAPT (0.47) ALDH1A1HTTGAARAB9AMAPT
SCHEMBL19897775 0.78 HPGD (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL30394063 0.78 HPGD (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL6769122 0.78 SMN1; SMN2 (0.67) SMN1; SMN2NPC1ALDH1A1GAARAB9A
SCHEMBL28360337 0.77 L3MBTL1 (0.40) SMN1; SMN2KMT2AALDH1A1GAAMAPT
SCHEMBL18190399 0.77 P2RX7 (0.50) SMN1; SMN2KMT2ANPC1MEN1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730940-A Heterocyclic substituted biphenyl compound and medical application thereof 中国药科大学 2023-09-12 CN disclosed
CN-113307779-A Heterocyclic substituted biphenyl compound, preparation method and application 中国药科大学 2021-08-27 CN disclosed