SCHEMBL4238396

SCHEMBL4238396

CC(C)N1CCC(COc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.53
PARP15 Q460N3 4/20 0.51
PARP10 Q53GL7 4/20 0.51
PARP2 Q9UGN5 2/20 0.51
SSTR5 P35346 1/20 0.48
KCNH2 Q12809 1/20 0.48
MAPK1 P28482 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
SRD5A2 P31213 1/20 0.46

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
SCHEMBL4229372 0.85 KDM2B (0.50) HRH3PARP15PARP10PARP2MAPK1
SCHEMBL7581468 0.85 PARP15 (0.55) PARP15PARP10PARP2SSTR5KCNH2
SCHEMBL416244 0.82 PARP15 (0.72) PARP15PARP10PARP2MAPK1NR1H4
SCHEMBL4240603 0.82 HRH3 (0.51) HRH3KCNH2
SCHEMBL14174984 0.81 HRH3 (0.48) HRH3
SCHEMBL2885506 0.79 PARP10 (0.73) PARP15PARP10PARP2MAPK1NR1H4
SCHEMBL12420703 0.79 PARP10 (0.73) PARP15PARP10PARP2NR1H4
SCHEMBL384351 0.79 GPR119 (0.60) SRD5A2
SCHEMBL15539329 0.79 SSTR5 (0.55) HRH3PARP15PARP10PARP2SSTR5
SCHEMBL4228646 0.79 HRH3 (0.70) HRH3

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 4 patents. 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
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
CN-101198604-A NPY antagonists, their preparation and use CEREP (FR) 2008-06-11 CN 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 HRH3 210/4885PARP15 2421/4885PARP10 2499/4885

“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.