SCHEMBL7273349

SCHEMBL7273349

CCCCCOC(=O)C1=C(C)Nc2c(c(C(C)(C)C)nn2C)C1c1ccccc1CC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KMT2A Q03164 1/20 0.43
CACNA1F O60840 1/20 0.39
CACNA1D Q01668 1/20 0.39
CACNA1S Q13698 1/20 0.39
CACNA1C Q13936 1/20 0.39
HTT P42858 2/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NSD2 O96028 1/20 0.36
CYP1A2 P05177 1/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36
GAA P10253 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL7272340 0.89 LMNA (0.45) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7272900 0.88 LMNA (0.45) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7271095 0.88 CACNA1C (0.42) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7280554 0.87 LMNA (0.43) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7271027 0.83 ALDH1A1 (0.46) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7272890 0.81 LMNA (0.51) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7271051 0.78 ACHE (0.53) LMNAALDH1A1MAPTKMT2ACACNA1F
SCHEMBL7272968 0.78 CACNA1C (0.50) LMNAALDH1A1MAPTKMT2ACACNA1F
SCHEMBL7272539 0.77 CACNA1F (0.43) LMNAALDH1A1MAPTNPSR1KMT2A
SCHEMBL7278535 0.77 CACNA1F (0.44) LMNAALDH1A1MAPTNPSR1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0114273-B1 NEW PHARMACOLOGICALLY ACTIVE PYRAZOLOPYRIDINES GRUPPO LEPETIT S.p.A. (IT) 1991-11-06 EP disclosed
US-4954508-A HYPOTENSIVE GRUPPO LEPETIT S.P.A. (IT) 1990-09-04 US disclosed
EP-0114273-A1 New pharmacologically active pyrazolopyridines GRUPPO LEPETIT S.p.A. (IT) 1984-08-01 EP disclosed