SCHEMBL29684181

SCHEMBL29684181

COCCOc1cccc(NC(=O)c2cccs2)c1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.74
RAB9A P51151 3/20 0.74
NPC1 O15118 2/20 0.74
KMT2A Q03164 9/20 0.64
MEN1 O00255 8/20 0.64
MAPT P10636 4/20 0.64
LMNA P02545 2/20 0.64
HPGD P15428 2/20 0.64
ADRB2 P07550 1/20 0.64
MAPK1 P28482 2/20 0.58
RECQL P46063 1/20 0.58
HSD17B10 Q99714 1/20 0.57
TP53 P04637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
POLB P06746 1/20 0.56
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL29684416 0.86 KMT2A (0.73) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL2530312 0.85 RAB9A (1.00) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL24711491 0.82 KMT2A (0.69) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL29684366 0.81 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL29684622 0.80 MAPK1 (0.59) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL23011772 0.79 KCNK3 (0.82) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL15499643 0.79 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL21768134 0.77 THRB (0.61) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL29684800 0.77 APLNR (0.73) SMN1; SMN2RAB9AKMT2AMEN1MAPT
SCHEMBL12496157 0.76 KCNK3 (0.82) SMN1; SMN2RAB9ANPC1KMT2AMEN1

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-114763346-B Compounds for inducing cartilage formation and application thereof 华东师范大学 2025-06-10 CN disclosed
CN-114763346-A Compound for inducing chondrogenesis and application thereof 华东师范大学 2022-07-19 CN disclosed