SCHEMBL565226

SCHEMBL565226

COc1ccccc1CNC(C)CC(=O)N(Cc1ccc2c(c1)OCCCO2)CC(C)C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.46
MAPK1 P28482 1/20 0.46
TACR1 P25103 1/20 0.45
PKM P14618 1/20 0.43
PTGES O14684 1/20 0.41
MCHR1 Q99705 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 1/20 0.39
PROKR2 Q8NFJ6 1/20 0.38

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
SCHEMBL565005 0.87 ALDH1A1 (0.44) ALDH1A1HPGDPKMNPC1RAB9A
SCHEMBL565227 0.79 SMN1; SMN2 (0.41) ALDH1A1HPGDPKMNPC1RAB9A
SCHEMBL565373 0.77 TAAR1 (0.41) ALDH1A1HPGDLMNAHTTTSHR
SCHEMBL563698 0.77 PROKR2 (0.57) ALDH1A1PKMMCHR1LMNAPROKR2
SCHEMBL3518632 0.76 PROKR2 (0.64) ALDH1A1HPGDMAPK1TACR1PKM
SCHEMBL10106720 0.76 PROKR2 (0.58) ALDH1A1LMNAPROKR2
SCHEMBL3518689 0.76 PROKR2 (0.64) ALDH1A1HPGDMAPK1TACR1PKM
SCHEMBL565243 0.76 PROKR2 (0.58) ALDH1A1LMNAPROKR2
SCHEMBL564825 0.76 SMN1; SMN2 (0.43) ALDH1A1HPGDNPC1RAB9ALMNA
SCHEMBL565214 0.75 TSHR (0.42) ALDH1A1HPGDNPC1RAB9ALMNA

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 6 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-8722896-B2 Prokineticin receptor antagonists and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-05-13 US disclosed
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
US-20120035149-A1 Prokineticin Receptor Antagonists And Uses Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-09 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 ALDH1A1 4725/4885HPGD 820/4885MAPK1 1691/4885

“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.