SCHEMBL24695982

SCHEMBL24695982

CC(C)c1cc(C2CCCCC2)nc2cc(C(=O)O)nn12

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.48
▸ ALDH1A1 P00352 6/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ BLM P54132 1/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ KMO O15229 1/20 0.45
▸ KDM4E B2RXH2 7/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ HTT P42858 3/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPT P10636 2/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ APP P05067 1/20 0.37

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
SCHEMBL24696333 0.87 HPGD (0.60) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24695614 0.86 KDM4E (0.41) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24695817 0.85 KDM4E (0.46) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24696127 0.81 KDM4E (0.40) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24696374 0.81 KDM4E (0.40) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24696319 0.81 HPGD (0.52) HPGDALDH1A1HSD17B10POLBKMO
SCHEMBL24695635 0.81 KMO (0.44) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24695808 0.81 KMO (0.44) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24695613 0.81 KDM4E (0.39) HPGDALDH1A1HSD17B10POLBBLM
SCHEMBL24696323 0.81 KDM4E (0.39) HPGDALDH1A1HSD17B10POLBBLM

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
WO-2022255408-A1 PYRAZOLO[1,5-A]PYRIMIDINE COMPOUND FOR THE TREATMENT OF DERMAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-12-08 — — WO disclosed
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