SCHEMBL24093933

SCHEMBL24093933

CC(O)c1nn(CC(=O)O)c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.58
▸ ALOX15 P16050 2/20 0.47
▸ GLA P06280 1/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ HPGD P15428 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CMA1 P23946 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ APEX1 P27695 1/20 0.42

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
SCHEMBL23368488 0.85 HSD17B10 (0.58) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL18576516 0.85 KDM4E (0.62) HSD17B10KDM4EHPGDALDH1A1KMT2A
SCHEMBL23213705 0.84 HSD17B10 (0.60) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL29845235 0.84 HSD17B10 (0.60) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL24114234 0.81 PTGDR2 (0.43) HSD17B10LMNAHTTSMN1; SMN2PTGDR2
SCHEMBL3426834 0.81 PDE5A (0.52) HSD17B10ALOX15KDM4EHPGDALDH1A1
SCHEMBL3354341 0.78 HSD17B10 (0.65) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL3905353 0.76 HSD17B10 (0.67) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL14631512 0.76 HSD17B10 (0.67) HSD17B10ALOX15GLAKDM4EHPGD
SCHEMBL21159736 0.76 NTSR1 (0.45) HSD17B10

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
EP-3340982-B1 COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2021-12-15 — — EP disclosed
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