SCHEMBL24696355

SCHEMBL24696355

CCOC(=O)c1cc2nc(CCC3CCCCC3)cc(C(C)C)n2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.40
▸ HPGD P15428 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ POLB P06746 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ FAAH O00519 5/20 0.36
▸ CTSK P43235 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HSD17B10 Q99714 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ MMP2 P08253 1/20 0.34
▸ BMP1 P13497 1/20 0.34
▸ PLA2G1B P04054 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ATG4B Q9Y4P1 1/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ AKT2 P31751 1/20 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
SCHEMBL24696352 0.99 KDM4E (0.41) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24695643 0.90 SMN1; SMN2 (0.39) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24695973 0.90 SMN1; SMN2 (0.39) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696342 0.89 KDM4E (0.38) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696374 0.88 KDM4E (0.40) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24695812 0.87 KDM4E (0.38) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696353 0.87 KDM4E (0.42) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696356 0.87 KDM4E (0.41) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696376 0.86 KDM4E (0.41) KDM4EHPGDALDH1A1POLBSMN1; SMN2
SCHEMBL24696358 0.86 KDM4E (0.43) KDM4EHPGDALDH1A1POLBSMN1; SMN2

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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