SCHEMBL6992090

SCHEMBL6992090

Cc1ccccc1CCn1ccnc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.71
CYP11B2 P19099 2/20 0.71
CYP19A1 P11511 3/20 0.56
TBXAS1 P24557 3/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
LMNA P02545 2/20 0.54
MAPK1 P28482 2/20 0.54
PRKCI P41743 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL15179017 0.88 CYP19A1 (0.64) CYP11B1CYP11B2CYP19A1TBXAS1
SCHEMBL9323999 0.87 CYP11B1 (0.58) CYP11B1CYP11B2CYP19A1TBXAS1MEN1
SCHEMBL30674929 0.87 CYP11B1 (0.58) CYP11B1CYP11B2CYP19A1TBXAS1MEN1
SCHEMBL1509681 0.83 CYP11B1 (1.00) CYP11B1CYP11B2CYP19A1TBXAS1MEN1
Iodide SCHEMBL28192688 0.81 CYP11B1 (0.97) CYP11B1CYP11B2CYP19A1TBXAS1MEN1
Hydrochloric Acid SCHEMBL28135987 0.81 CYP11B1 (0.97) CYP11B1CYP11B2CYP19A1TBXAS1MEN1
SCHEMBL9414537 0.80 CYP19A1 (0.56) CYP11B1CYP11B2CYP19A1TBXAS1
SCHEMBL15173640 0.80 CYP19A1 (0.56) CYP11B1CYP11B2CYP19A1TBXAS1
SCHEMBL11607374 0.80 ALDH1A1 (0.57) CYP11B1CYP11B2CYP19A1TBXAS1LMNA
SCHEMBL27311222 0.80 CYP19A1 (0.56) CYP11B1CYP11B2CYP19A1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588858-B1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA NV (BE) 2003-09-17 EP disclosed
CN-1142360-A A method for preparing a medical composition conpaining imidazo[2,1-b][3] benzo azepine dericvants YUAN ANLING (CN) 1997-02-12 CN disclosed
US-5468743-A Imidazo[2,1-b]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1995-11-21 US disclosed
EP-0588858-A1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-30 EP disclosed
WO-1992022551-A1 IMIDAZO[2,1-b][3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-23 WO disclosed
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP disclosed