SCHEMBL7429437

SCHEMBL7429437

CCOC(=O)N1CCN(c2nc3ccccc3n2C)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.65
ALDH1A1 P00352 4/20 0.61
SMN1; SMN2 Q16637 5/20 0.59
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
HPGD P15428 2/20 0.56
NPSR1 Q6W5P4 2/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 2/20 0.53
GAA P10253 1/20 0.53
POLB P06746 1/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53
HSD11B1 P28845 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.52

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
SCHEMBL6995118 0.82 KDM4E (0.63) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6597555 0.81 ALDH1A1 (0.59) ALDH1A1NPSR1
SCHEMBL13033531 0.81 SMO (0.55) KMT2AMEN1ALDH1A1LMNAHTT
SCHEMBL9537236 0.80 MAPT (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2HPGD
SCHEMBL8567429 0.78 HTR3E (0.75) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL3892502 0.78 ALDH1A1 (0.61) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL13182068 0.76 RXFP1 (0.58) KMT2AMEN1ALDH1A1HTTMAPT
SCHEMBL8776022 0.76 HSD11B1 (0.62) HSD11B1
SCHEMBL7494045 0.76 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL7427136 0.75 HSD11B1 (0.56) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5256665-A Process for preparing new 2-piperazinylbenzimidazole FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (ES) 1993-10-26 US claimed
EP-0512939-A1 New 2-piperazinylbenzimidazole derivatives FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (FAES) (ES) 1992-11-11 EP claimed
EP-0512939-B1 2-piperazinylbenzimidazole derivatives ESPANOLA PROD QUIMICOS (ES) 1999-08-25 EP disclosed
US-5256665-A Process for preparing new 2-piperazinylbenzimidazole FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (ES) 1993-10-26 US disclosed
EP-0512939-A1 New 2-piperazinylbenzimidazole derivatives FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (FAES) (ES) 1992-11-11 EP disclosed