SCHEMBL565394

SCHEMBL565394

CC(C)CNCc1cc(Cl)c2c(c1)OCCCO2

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 5/20 0.44
POLB P06746 1/20 0.42
MAPK8 P45983 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRK1 P41145 1/20 0.32
KCNH2 Q12809 1/20 0.32
BDKRB1 P46663 1/20 0.31

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
SCHEMBL10106587 0.86 ALDH1A1 (0.37) PROKR2POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL10120069 0.85 ALDH1A1 (0.39) PROKR2POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL3518641 0.78 ALDH1A1 (0.59) ALDH1A1MEN1KMT2AKDM4ETSHR
SCHEMBL13039056 0.75 ALDH1A1 (0.59) ALDH1A1MEN1KMT2AKDM4ETSHR
SCHEMBL564965 0.75 PROKR2 (0.64) PROKR2MAPK8SMN1; SMN2NPC1RAB9A
SCHEMBL13039536 0.74 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4ETSHR
SCHEMBL15693909 0.73 PROKR2 (0.69) PROKR2MAPK8ALDH1A1SMN1; SMN2MEN1
SCHEMBL565109 0.73 PROKR2 (0.69) PROKR2MAPK8ALDH1A1SMN1; SMN2MEN1
SCHEMBL565524 0.73 PROKR2 (0.69) PROKR2MAPK8ALDH1A1SMN1; SMN2MEN1
SCHEMBL564400 0.73 PROKR2 (0.60) PROKR2MAPK8ALDH1A1SMN1; SMN2TSHR

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 3 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
WO-2010077976-A2 PROKINETICIN RECEPTOR ANTAGONISTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-07-08 WO 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 1/4885POLB 3608/4885MAPK8 1270/4885

“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.