SCHEMBL10119857

SCHEMBL10119857

COc1ccc(CN2CCC(C(=O)N(Cc3cc(Cl)c4c(c3)OCCCO4)CC(C)C)C2)cc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 5/20 0.64
KDM4E B2RXH2 5/20 0.42
S1PR1 P21453 1/20 0.41
S1PR5 Q9H228 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
DRD4 P21917 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
SCHEMBL565724 1.00 PROKR2 (0.64) PROKR2KDM4ES1PR1S1PR5ALDH1A1
SCHEMBL10106771 0.92 PROKR2 (0.62) PROKR2KDM4ES1PR1S1PR5ALDH1A1
SCHEMBL565463 0.91 PROKR2 (0.62) PROKR2KDM4ES1PR1S1PR5ALDH1A1
SCHEMBL564918 0.90 PROKR2 (0.63) PROKR2KDM4EALDH1A1LMNAPDCD1
SCHEMBL10107208 0.90 PROKR2 (0.63) PROKR2KDM4EALDH1A1LMNAPDCD1
SCHEMBL10119856 0.90 PROKR2 (0.66) PROKR2KDM4EALDH1A1KMT2AMEN1
SCHEMBL565020 0.90 PROKR2 (0.66) PROKR2KDM4EALDH1A1KMT2AMEN1
SCHEMBL565506 0.89 PROKR2 (0.66) PROKR2KDM4EALDH1A1KMT2AMEN1
SCHEMBL564423 0.88 PROKR2 (0.66) PROKR2KDM4EALDH1A1KMT2AMEN1
SCHEMBL564621 0.88 PROKR2 (0.81) PROKR2KDM4ES1PR1ALDH1A1KMT2A

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-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 4874/4885S1PR1 1759/4885

“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.