SCHEMBL24696365

SCHEMBL24696365

CCOC(=O)c1cc2nc(CC3CCCC3)cc(C(CC)CC)n2n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ FAAH O00519 4/20 0.36
▸ AKT1 P31749 1/20 0.35
▸ AKT2 P31751 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ CSNK1D P48730 1/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ ADORA3 P0DMS8 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
SCHEMBL24696033 0.99 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695601 0.99 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695818 0.92 KDM4E (0.38) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24696144 0.91 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695640 0.91 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24696342 0.91 KDM4E (0.38) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695643 0.90 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695973 0.90 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24695812 0.89 KDM4E (0.38) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL24696366 0.88 KDM4E (0.38) KDM4EALDH1A1HPGDPOLBKMT2A

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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