SCHEMBL27460992

SCHEMBL27460992

NCc1ccc(CCn2ccnc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 4/20 0.60
CYP19A1 P11511 3/20 0.60
KMT2A Q03164 1/20 0.60
HMOX1 P09601 3/20 0.56
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50

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
SCHEMBL27508985 0.87 CYP11B1 (0.51) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL4316370 0.86 CYP11B1 (0.69) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL570591 0.83 CYP11B1 (0.66) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL10788342 0.82 TBXAS1 (0.65) TBXAS1CYP19A1KMT2AHMOX1
SCHEMBL6986190 0.82 HMOX1 (0.79) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL16719036 0.82 CYP19A1 (0.81) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL6987156 0.82 CYP19A1 (0.69) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
SCHEMBL7284368 0.81 CYP11B1 (0.73) TBXAS1CYP19A1CYP11B1CYP11B2
SCHEMBL409741 0.81 HMOX1 (0.72) TBXAS1CYP19A1KMT2AHMOX1CYP11B1
Hydrochloric Acid SCHEMBL7527357 0.80 HMOX1 (0.70) TBXAS1CYP19A1KMT2AHMOX1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1068118-A Imidazo [2, 1-b ] [3] benzazepine derivatives, compositions and methods of use JANSSEN PHARMACEUTICA NV (BE) 1993-01-20 CN disclosed