SCHEMBL4242399

SCHEMBL4242399

COc1cc(C#N)ccc1OC12CCCC(CC1)N2C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.40
CYP11B2 P19099 4/20 0.38
CYP11B1 P15538 1/20 0.38
PRKDC P78527 2/20 0.37
PDE4B Q07343 1/20 0.36
KDM1A O60341 1/20 0.35
ALK Q9UM73 3/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
PDE10A Q9Y233 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
ICMT O60725 1/20 0.34
PIK3CA P42336 1/20 0.34
MAPK7 Q13164 1/20 0.34

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
SCHEMBL4238953 0.86 USP30 (0.37) CYP11B2CYP11B1KDM1A
SCHEMBL4234192 0.81 HRH3 (0.44)
SCHEMBL4240943 0.78 CA12 (0.49) PDE4B
SCHEMBL21501064 0.70 AR (0.60) ARCYP11B2CYP11B1PDE4BKDM1A
SCHEMBL4237914 0.70 KDM1A (0.36) CYP11B2CYP11B1KDM1A
SCHEMBL29490258 0.68 AR (0.66) ARCYP11B2CYP11B1PDE4BKDM1A
SCHEMBL509522 0.68 AR (0.66) ARCYP11B2CYP11B1PDE4BKDM1A
SCHEMBL4234289 0.67 MEN1 (0.32)
SCHEMBL523610 0.66 HRH3 (0.61) ARCYP11B2ALKPDE3BPDE3A
SCHEMBL6941777 0.65 AR (0.49) ARCYP11B2CYP11B1PDE4BKDM1A

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
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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 (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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R AR 1029/4885CYP11B2 535/4885CYP11B1 572/4885

“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.