SCHEMBL29690686

SCHEMBL29690686

Clc1cccc2sc(C3CCCC3)nc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.51
PDE10A Q9Y233 1/20 0.51
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
RAB9A P51151 2/20 0.50
MAPT P10636 5/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PSMB8 P28062 1/20 0.47
NPC1 O15118 2/20 0.43
UBE2M P61081 2/20 0.42
DCUN1D1 Q96GG9 2/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 2/20 0.41
ADORA3 P0DMS8 2/20 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
SCHEMBL7519836 0.81 LMNA (0.45) LMNAPDE10AHPGDSMN1; SMN2RAB9A
SCHEMBL4673792 0.81 KMT2A (0.42) LMNAHPGDSMN1; SMN2RAB9AKMT2A
SCHEMBL29690517 0.80 LMNA (0.44) LMNAPDE10AHPGDSMN1; SMN2RAB9A
SCHEMBL333081 0.77 KMT2A (0.39) LMNAHPGDSMN1; SMN2RAB9AKMT2A
SCHEMBL24213033 0.77 LMNA (0.44) LMNAPDE10AHPGDSMN1; SMN2RAB9A
SCHEMBL29690673 0.76 LMNA (0.50) LMNAPDE10AHPGDSMN1; SMN2RAB9A
SCHEMBL28471930 0.74 KMT2A (0.37) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL5637621 0.73 KMT2A (0.73) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL816962 0.71 KMT2A (0.71) LMNAHPGDSMN1; SMN2MAPTKMT2A
SCHEMBL30702394 0.71 KMT2A (0.71) LMNAHPGDSMN1; SMN2MAPTKMT2A

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-114605349-A Method for synthesizing photocatalytic alkyl-substituted benzothiazole derivative 浙江工业大学 2022-06-10 CN disclosed