SCHEMBL24696359

SCHEMBL24696359

C=C(C)c1cc(CC2CCC(C)CC2)nc2cc(C(=O)OCC)nn12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.36
▸ HPGD P15428 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ POLB P06746 2/20 0.36
▸ KMT2A Q03164 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ATM Q13315 1/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ NPC1 O15118 1/20 0.31

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
SCHEMBL24695994 0.93 KDM4E (0.37) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695642 0.92 KDM4E (0.38) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24696344 0.92 KDM4E (0.38) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24696248 0.91 KDM4E (0.38) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695974 0.91 SMN1; SMN2 (0.39) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695607 0.89 KDM4E (0.40) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695843 0.89 KDM4E (0.35) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24696049 0.86 ALOX5 (0.34) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695976 0.86 HPGD (0.39) KDM4EHPGDALDH1A1POLBKMT2A
SCHEMBL24695978 0.85 HPGD (0.38) KDM4EHPGDALDH1A1POLBKMT2A

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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