SCHEMBL29317977

SCHEMBL29317977

CC(C)(CC(C)(C)C(=O)ON1C(=O)CCC1=O)C(=O)OCCOCCNC(=O)CCSSc1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 5/20 0.33
ALDH1A1 P00352 5/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
TP53 P04637 1/20 0.31
HSD17B10 Q99714 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL9906819 0.86 LMNA (0.34) SMN1; SMN2ALDH1A1NPC1RAB9ALMNA
SCHEMBL26479082 0.85 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL30915198 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL30621106 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL29702364 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL12107853 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL17256399 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL19725977 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL31121260 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL2607961 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1NPC1RAB9A

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
WO-2024146902-A1 METHODS OF PRODUCING HYDROGEL MICROSPHERES ASCENDIS PHARMA A/S (DK) 2024-07-11 WO disclosed
WO-2024146920-A1 DRUG CONJUGATES FOR THE TREATMENT OF OCULAR DISORDERS ASCENDIS PHARMA OPHTHALMOLOGY DIVISION A/S (DK) 2024-07-11 WO disclosed