SCHEMBL10106689

SCHEMBL10106689

COc1cccc(CN2CCC(C(=O)N(Cc3cc(Cl)c4c(c3)OCCCO4)CC(C)C)C2)c1OC

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 5/20 0.71
KDM4E B2RXH2 7/20 0.47
PDCD1 Q15116 7/20 0.43
CD274 Q9NZQ7 7/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RECQL P46063 1/20 0.42
MAPT P10636 2/20 0.40
THRB P10828 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL565164 1.00 PROKR2 (0.71) PROKR2KDM4EPDCD1CD274TSHR
SCHEMBL565419 0.94 PROKR2 (0.72) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL10107245 0.93 PROKR2 (0.71) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL565267 0.93 PROKR2 (0.71) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL10107198 0.92 PROKR2 (0.73) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL20915063 0.92 PROKR2 (0.71) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL565819 0.92 PROKR2 (0.73) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL20936221 0.92 PROKR2 (0.71) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL20936154 0.90 PROKR2 (0.67) PROKR2KDM4EPDCD1CD274ALDH1A1
SCHEMBL20915078 0.90 PROKR2 (0.67) PROKR2KDM4EPDCD1CD274ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722896-B2 Prokineticin receptor antagonists and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-05-13 US disclosed
US-20120035149-A1 Prokineticin Receptor Antagonists And Uses Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-09 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-20120035149-A1 Prokineticin Receptor Antagonists And Uses Thereof PROKR2, PROKR1, GIPR PROKR2 1/4885KDM4E 4874/4885PDCD1 4590/4885

“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.