SCHEMBL28778304

SCHEMBL28778304

Nc1cccc(N2CCCC2C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
SERPINE1 P05121 1/20 0.43
HSD11B1 P28845 1/20 0.42
ADRA2C P18825 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CHRNB2 P17787 2/20 0.40
CHRNA4 P43681 2/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
NOTUM Q6P988 2/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL3909608 0.83 SCN9A (0.43) ADRA2CCHRNB2CHRNA4GAA
SCHEMBL3909612 0.83 SCN9A (0.43) ADRA2CCHRNB2CHRNA4GAA
SCHEMBL432319 0.82 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2MAPTALDH1A1NOTUM
SCHEMBL630857 0.82 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2MAPTALDH1A1NOTUM
SCHEMBL15664724 0.82 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2MAPTALDH1A1NOTUM
SCHEMBL11985529 0.82 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2MAPTSERPINE1HSD11B1
SCHEMBL3450033 0.82 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2MAPTSERPINE1HSD11B1
SCHEMBL3450292 0.82 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2MAPTSERPINE1HSD11B1
SCHEMBL11983557 0.82 SMN1; SMN2 (0.43) KMT2ASMN1; SMN2MAPTSERPINE1HSD11B1
SCHEMBL4715449 0.81 SMN1; SMN2 (0.44) KMT2ASMN1; SMN2MAPTALDH1A1CHRNB2

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
CN-114599389-A Variant FC domains and uses thereof 奇达拉治疗公司 2022-06-07 CN disclosed