SCHEMBL9694131

SCHEMBL9694131

CCOC(=O)CNc1cc(C)nc(N(CC)CC)c1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
GLA P06280 1/20 0.44
MAPT P10636 7/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 3/20 0.36
POLB P06746 1/20 0.36
CASP3 P42574 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
MCL1 Q07820 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MITF O75030 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
AGTR1 P30556 1/20 0.35

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
SCHEMBL9693453 0.75 LMNA (0.44) LMNAMAPTGAAKDM4EALDH1A1
SCHEMBL9694220 0.71 LMNA (0.53) LMNAGLAMAPTGAAKDM4E
SCHEMBL9693689 0.71 ALDH1A1 (0.44) LMNAMAPTALDH1A1TDP1POLB
SCHEMBL9956111 0.70 LMNA (0.55) LMNAGLAMAPTGAAKDM4E
SCHEMBL2844617 0.70 LMNA (0.45) LMNAGLAMAPTGAAKDM4E
SCHEMBL22085608 0.69 LMNA (0.54) LMNAGLAMAPTKDM4EALDH1A1
SCHEMBL2798845 0.68 LMNA (0.52) LMNAGLAMAPTGAAKDM4E
SCHEMBL8607862 0.68 LMNA (0.72) LMNAMAPTGAAKDM4EALDH1A1
SCHEMBL9955508 0.68 LMNA (0.52) LMNAGLAMAPTKDM4EALDH1A1
SCHEMBL26841476 0.68 LMNA (0.61) LMNAGLAMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255217-B1 FUSED IMIDAZOHETEROCYCLIC COMPOUNDS A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1992-01-22 EP disclosed
US-4948800-A MUSCLE RELAXANTS; ANTICONVULSANTS; ANXIOLYTIC AGENTS; 3-HYDROXYALKYL-PYRIDO(4,5-B OR-C)IMIDAZOLE COMPOUNDS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-14 US disclosed
US-4914109-A ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-04-03 US disclosed
US-4873251-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-10-10 US disclosed
US-4824951-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-04-25 US disclosed
US-4772600-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC A. H. ROBINS COMPANY, INC. (US) 1988-09-20 US disclosed
EP-0255217-A1 Fused imidazoheterocyclic compounds A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1988-02-03 EP disclosed