SCHEMBL3685371

SCHEMBL3685371

Cn1c(-c2c[c]c(C(N)=O)nc2)c(C#N)c2ccc(Cl)cc21

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.55
MAOA P21397 3/20 0.55
CYP11B1 P15538 2/20 0.55
CYP19A1 P11511 1/20 0.47
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
MAP2 P11137 1/20 0.32
MAP4K4 O95819 2/20 0.32
NTRK1 P04629 1/20 0.32
MAPT P10636 2/20 0.32
MAT2A P31153 1/20 0.32
POLB P06746 1/20 0.32
TBXAS1 P24557 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL3683229 0.89 CYP11B2 (0.41) CYP11B2MAOACYP11B1CYP19A1SCN9A
SCHEMBL3685274 0.85 CYP11B2 (0.53) CYP11B2MAOACYP11B1
SCHEMBL3678336 0.78 CYP11B2 (0.64) CYP11B2MAOACYP11B1CYP19A1MAP4K4
SCHEMBL3680547 0.75 CYP11B2 (0.62) CYP11B2MAOACYP11B1CYP19A1CNR1
SCHEMBL1605831 0.73 CYP11B2 (0.65) CYP11B2MAOACYP11B1CYP19A1CNR1
SCHEMBL1606814 0.72 CYP11B2 (0.71) CYP11B2MAOACYP11B1CYP19A1NTRK1
SCHEMBL1606810 0.72 CYP11B2 (1.00) CYP11B2MAOACYP11B1CYP19A1NTRK1
SCHEMBL3680909 0.71 CYP11B2 (0.49) CYP11B2MAOACYP11B1CYP19A1NTRK1
SCHEMBL1605285 0.71 CYP11B2 (0.72) CYP11B2MAOACYP11B1CYP19A1NTRK1
SCHEMBL1606125 0.70 CYP11B2 (0.67) CYP11B2MAOACYP11B1CYP19A1NTRK1

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-2307371-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2017-10-04 EP disclosed
US-9242963-B2 Organic compounds NOVARTIS AG (CH) 2016-01-26 US disclosed
US-20150210672-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2015-07-30 US disclosed
US-20140288126-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-09-25 US disclosed
US-8791141-B2 Organic compounds NOVARTIS AG (CH) 2014-07-29 US disclosed
US-20100261698-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-10-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261698-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CYP11B2 13/4885MAOA 193/4885CYP11B1 14/4885
US-20150210672-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CYP11B2 12/4885MAOA 198/4885CYP11B1 15/4885
US-20140288126-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 CYP11B2 12/4885MAOA 198/4885CYP11B1 15/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.