SCHEMBL807835

SCHEMBL807835

Cc1ccncc1N1CCc2ccc(-c3ccc(F)cc3)cc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 11/20 0.42
CYP11B1 P15538 6/20 0.42
P2RX7 Q99572 1/20 0.39
MAP3K5 Q99683 1/20 0.38
HRH3 Q9Y5N1 3/20 0.37
SRD5A1 P18405 1/20 0.37
CYP19A1 P11511 2/20 0.36
PRF1 P14222 1/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL793824 0.85 CYP11B2 (0.46) CYP11B2CYP11B1P2RX7CYP19A1
SCHEMBL15471694 0.83 MAPT (0.43) CYP11B2CYP11B1CYP19A1
SCHEMBL797877 0.82 CYP11B2 (0.41) CYP11B2CYP11B1MAP3K5
SCHEMBL12467032 0.82 CYP11B2 (0.52) CYP11B2CYP11B1P2RX7
SCHEMBL793377 0.81 CYP11B2 (0.51) CYP11B2CYP11B1SRD5A1
SCHEMBL793768 0.81 CYP11B2 (0.41) CYP11B2CYP11B1CYP19A1
SCHEMBL793449 0.81 PARP1 (0.42) CYP11B2CYP11B1P2RX7CYP19A1
SCHEMBL807907 0.81 CYP11B2 (0.43) CYP11B2CYP11B1
SCHEMBL793782 0.81 CDC7 (0.40) CYP11B2CYP11B1P2RX7
SCHEMBL794131 0.80 CYP11B2 (0.47) CYP11B2CYP11B1P2RX7

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
US-8946260-B2 17α-hydroxylase/C17,20-lyase inhibitors NOVARTIS AG (CH) 2015-02-03 US disclosed
US-8946260-B2 17α-hydroxylase/C17,20-lyase inhibitors NOVARTIS AG (CH) 2015-02-03 US disclosed
US-8946260-B2 17α-hydroxylase/C17,20-lyase inhibitors NOVARTIS AG (CH) 2015-02-03 US disclosed
US-20140045872-A1 17a-HYDROXYLASE/C17,20-LYASE INHIBITORS NOVARTIS AG (CH) 2014-02-13 US disclosed
US-20140045872-A1 17a-HYDROXYLASE/C17,20-LYASE INHIBITORS NOVARTIS AG (CH) 2014-02-13 US disclosed
US-20140045872-A1 17a-HYDROXYLASE/C17,20-LYASE INHIBITORS NOVARTIS AG (CH) 2014-02-13 US disclosed
WO-2012035078-A1 17α-HYDROXYLASE/C17,20-LYASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 WO 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 (1 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-20140045872-A1 17a-HYDROXYLASE/C17,20-LYASE INHIBITORS CYP17A1, CYP21A2, HSD17B1 CYP11B2 30/4885CYP11B1 18/4885P2RX7 4321/4885

“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.