SCHEMBL565126

SCHEMBL565126

CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)C(C)CNCCc1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 5/20 0.64
ADRB1 P08588 4/20 0.35
ADRB2 P07550 3/20 0.35
MAPK8 P45983 1/20 0.34
MTNR1A P48039 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SMYD2 Q9NRG4 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 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
SCHEMBL565042 0.90 PROKR2 (0.61) PROKR2ADRB1ADRB2MTNR1AALDH1A1
SCHEMBL565414 0.87 PROKR2 (0.74) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL565130 0.86 PROKR2 (0.73) PROKR2MAPK8MTNR1AALDH1A1NPC1
SCHEMBL565287 0.85 PROKR2 (0.72) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL565125 0.85 PROKR2 (0.57) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL565524 0.85 PROKR2 (0.69) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL15693909 0.85 PROKR2 (0.69) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL565109 0.85 PROKR2 (0.69) PROKR2MAPK8ALDH1A1NPC1RAB9A
SCHEMBL565681 0.85 PROKR2 (0.71) PROKR2MAPK8MTNR1AALDH1A1NPC1
SCHEMBL565268 0.85 PROKR2 (0.71) PROKR2MAPK8ALDH1A1NPC1RAB9A

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 1/4885ADRB1 364/4885ADRB2 138/4885

“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.