SCHEMBL24696366

SCHEMBL24696366

CCC(CC)c1cc(CC2CCCC2)nc2cc(C(=O)O)nn12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.38
▸ ALDH1A1 P00352 6/20 0.35
▸ P2RY14 Q15391 3/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ POLB P06746 2/20 0.34
▸ BLM P54132 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ APOBEC3A P31941 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ HTT P42858 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTR6 P50406 2/20 0.33

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
SCHEMBL24696321 0.99 KDM4E (0.38) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696032 0.99 KDM4E (0.38) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696318 0.91 KDM4E (0.38) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696142 0.90 KDM4E (0.38) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696320 0.90 KDM4E (0.38) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696348 0.88 KDM4E (0.40) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696365 0.88 KDM4E (0.38) KDM4EALDH1A1KMT2AHSD17B10POLB
SCHEMBL24696323 0.87 KDM4E (0.39) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24695613 0.87 KDM4E (0.39) KDM4EALDH1A1P2RY14KMT2AL3MBTL1
SCHEMBL24696322 0.86 KDM4E (0.40) KDM4EALDH1A1P2RY14KMT2AL3MBTL1

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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