SCHEMBL13731007

SCHEMBL13731007

CC(C)c1ccc2nc(-c3cc(F)cc(F)c3)cn2n1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 3/20 0.35
CSNK1E P49674 3/20 0.35
CYP11B2 P19099 3/20 0.35
CYP11B1 P15538 2/20 0.35
AHR P35869 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ALDH1A3 P47895 2/20 0.35
F2RL3 Q96RI0 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
APP P05067 1/20 0.33
PIK3CG P48736 1/20 0.33
DYRK1A Q13627 1/20 0.33
RIPK1 Q13546 1/20 0.32

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
SCHEMBL13731002 0.88 F2RL3 (0.48) NPC1RAB9AALDH1A3F2RL3TP53
SCHEMBL13750601 0.81 DYRK1A (0.41) CSNK1DCSNK1ECYP11B2CYP11B1AHR
SCHEMBL13730992 0.81 RAB9A (0.50) NPC1RAB9AALDH1A3F2RL3TP53
SCHEMBL4099914 0.78 DRD2 (0.42) CSNK1DCSNK1ECYP11B2CYP11B1AHR
SCHEMBL13730155 0.76 F2RL3 (0.46) CSNK1DCSNK1EAHRNPC1RAB9A
SCHEMBL798826 0.74 DYRK1A (0.34) AHRDYRK1A
SCHEMBL13729698 0.72 KDM4E (0.41) NPC1RAB9ATP53MAPTDYRK1A
SCHEMBL2067022 0.72 DYRK1A (0.50) AHRNPC1RAB9ADYRK1A
SCHEMBL17229848 0.70 AHR (0.37) CYP11B2CYP11B1AHRALDH1A3DYRK1A
SCHEMBL3342789 0.70 PDE10A (0.39) AHRDYRK1A

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-20090203705-A1 Spiro Compounds As NPY Y5 Receptor Antagonists GLAXO GROUP LIMITED (GB) 2009-08-13 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-20090203705-A1 Spiro Compounds As NPY Y5 Receptor Antagonists NPY4R, NPY1R, NPY5R CSNK1D 689/4885CSNK1E 1005/4885CYP11B2 804/4885

“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.