SCHEMBL24696341

SCHEMBL24696341

CCc1cc(CC2CCCC2)nc2cc(C(=O)O)nn12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ P2RY14 Q15391 3/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ GAA P10253 2/20 0.35
▸ APOBEC3A P31941 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ HTT P42858 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HTR6 P50406 2/20 0.34

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
SCHEMBL24696384 0.99 P2RY14 (0.37) KDM4EALDH1A1P2RY14L3MBTL1GAA
SCHEMBL24696143 0.99 P2RY14 (0.37) KDM4EALDH1A1P2RY14L3MBTL1GAA
SCHEMBL24696372 0.91 KDM4E (0.36) KDM4EALDH1A1P2RY14L3MBTL1GAA
SCHEMBL24696345 0.86 KDM4E (0.39) KDM4EALDH1A1GAAPOLBKMT2A
SCHEMBL24696255 0.85 HPGD (0.46) KDM4EALDH1A1L3MBTL1GAAPOLB
SCHEMBL24695686 0.85 HPGD (0.46) KDM4EALDH1A1L3MBTL1GAAPOLB
SCHEMBL24696260 0.85 HPGD (0.46) KDM4EALDH1A1L3MBTL1GAAPOLB
SCHEMBL24695685 0.85 HPGD (0.46) KDM4EALDH1A1L3MBTL1GAAPOLB
SCHEMBL24696039 0.85 HPGD (0.46) KDM4EALDH1A1L3MBTL1GAAPOLB
SCHEMBL24696013 0.84 P2RY14 (0.40) KDM4EALDH1A1P2RY14GAAHSD17B10

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
Send feedback