SCHEMBL9693771

SCHEMBL9693771

CN(C(=O)C1CCCN(c2ccc([N+](=O)[O-])c(/C=C3/NC(=O)NC3=O)c2)C1)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
ALDH1A1 P00352 6/20 0.42
MAPK1 P28482 1/20 0.42
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
GAA P10253 3/20 0.39
LMNA P02545 2/20 0.39
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
CTSB P07858 1/20 0.35
HPGD P15428 1/20 0.35
SERPINE1 P05121 2/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL9693775 1.00 MAPT (0.42) MAPTALDH1A1MAPK1PDE3BPDE3A
SCHEMBL9694044 0.91 PDE3B (0.49) MAPTALDH1A1MAPK1PDE3BPDE3A
SCHEMBL9694051 0.91 PDE3B (0.49) MAPTALDH1A1MAPK1PDE3BPDE3A
SCHEMBL10744861 0.85 MAPT (0.49) MAPTALDH1A1MAPK1PDE3BPDE3A
SCHEMBL9693729 0.83 ALDH1A1 (0.51) MAPTALDH1A1MAPK1KDM4ECYP1A2
SCHEMBL9693725 0.83 ALDH1A1 (0.51) MAPTALDH1A1MAPK1KDM4ECYP1A2
SCHEMBL9691943 0.79 HPGD (0.51) MAPTALDH1A1MAPK1GAALMNA
SCHEMBL9691948 0.79 HPGD (0.51) MAPTALDH1A1MAPK1GAALMNA
SCHEMBL9693493 0.78 MAPT (0.51) MAPTALDH1A1MAPK1GAALMNA
SCHEMBL9693489 0.78 MAPT (0.51) MAPTALDH1A1MAPK1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0252503-B1 AMINOIMIDAZOQUINOLINE DERIVATIVES Bristol-Myers Squibb Company (US) 1992-11-19 EP disclosed
US-4701459-A 7-amino-1,3-dihydro-2H-imidazo[4,5-b]quinolin 2-ones and method for inhibiting phosphodiesterase and blood platelet aggregation BRISTOL-MYERS COMPANY (US) 1987-10-20 US disclosed