SCHEMBL24696151

SCHEMBL24696151

CCCCCc1cc(CC2CCCCC2)nc2cc(C(=O)N3CCCCCC3)nn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 11/20 0.42
▸ GAA P10253 2/20 0.42
▸ ALDH1A1 P00352 10/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HSD17B10 Q99714 7/20 0.38
▸ KDM4E B2RXH2 7/20 0.37
▸ CASP1 P29466 2/20 0.37
▸ CASP7 P55210 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ LMNA P02545 4/20 0.37
▸ HTT P42858 3/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ TDP1 Q9NUW8 2/20 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
SCHEMBL24696052 0.99 HPGD (0.42) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696220 0.97 HPGD (0.43) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696035 0.93 HPGD (0.44) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696213 0.93 HPGD (0.44) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696255 0.89 HPGD (0.46) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696260 0.89 HPGD (0.46) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24695686 0.89 HPGD (0.46) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24696039 0.89 HPGD (0.46) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24695685 0.89 HPGD (0.46) HPGDGAAALDH1A1MEN1KMT2A
SCHEMBL24695587 0.84 HPGD (0.44) HPGDGAAALDH1A1MEN1KMT2A

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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