SCHEMBL28844940

SCHEMBL28844940

N#Cc1cccc(CNC(=O)c2cccs2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.54
SENP5 Q96HI0 1/20 0.53
SENP2 Q9HC62 1/20 0.53
SENP1 Q9P0U3 1/20 0.53
ALDH1A1 P00352 3/20 0.52
ERCC1 P07992 1/20 0.51
ERCC4 Q92889 1/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALOX15 P16050 1/20 0.50
KDM4E B2RXH2 1/20 0.49
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL29732908 1.00 HPGD (0.54) HPGDSENP5SENP2SENP1ALDH1A1
SCHEMBL28844939 0.85 HPGD (0.63) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL18906063 0.81 HPGD (0.59) HPGDSENP5SENP2SENP1ALDH1A1
SCHEMBL13895327 0.80 HPGD (0.59) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28844872 0.80 NPC1 (0.64) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29732813 0.80 NPC1 (0.64) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29684591 0.78 NPC1 (0.59) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2925459 0.78 NPC1 (0.71) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9365904 0.78 MAOA (0.66) ERCC1ERCC4MAOAROCK2
SCHEMBL3461756 0.77 ERCC1 (0.60) ERCC1ERCC4SMN1; SMN2TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114763347-A Compound for inducing mesenchymal stem cells to differentiate towards cartilage and application thereof 华东师范大学 2022-07-19 CN claimed
CN-114763347-B Compound for inducing mesenchymal stem cells to differentiate into cartilage and application thereof 华东师范大学 2024-06-21 CN disclosed
CN-114763347-A Compound for inducing mesenchymal stem cells to differentiate towards cartilage and application thereof 华东师范大学 2022-07-19 CN disclosed