SCHEMBL874170

SCHEMBL874170

Oc1ccc(Br)cc1OC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.47
NPY2R P49146 1/20 0.47
ALOX15 P16050 2/20 0.44
ALOX12 P18054 1/20 0.44
PDE4B Q07343 4/20 0.38
SLC6A4 P31645 2/20 0.38
HTR6 P50406 1/20 0.38
CSNK2A1 P68400 1/20 0.37
PDE4D Q08499 3/20 0.37
PDE4A P27815 2/20 0.37
PDE4C Q08493 2/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL130056 0.96 ALOX15 (0.44) NPY1RNPY2RALOX15ALOX12SLC6A4
SCHEMBL128318 0.93 ALOX15 (0.46) NPY1RNPY2RALOX15ALOX12SLC6A4
SCHEMBL27792295 0.80 NPY1R (0.48) NPY1RNPY2RSLC6A4HTR6CSNK2A1
SCHEMBL29923985 0.79 EIF4E (0.40) PDE4BCSNK2A1PDE4DPDE4APDE4C
SCHEMBL22816372 0.79 CSNK2A1 (0.47) NPY1RNPY2RSLC6A4HTR6CSNK2A1
SCHEMBL129356 0.77 PDE4A (0.59) NPY1RNPY2RALOX15PDE4BPDE4D
SCHEMBL16695309 0.77 CSNK2A1 (0.46) NPY1RNPY2RSLC6A4HTR6CSNK2A1
SCHEMBL4585924 0.77 NPY1R (0.49) NPY1RNPY2RCSNK2A1KMT2A
SCHEMBL5704271 0.76 PDE4A (0.57) NPY1RNPY2RPDE4BPDE4DPDE4A
SCHEMBL7420271 0.76 NPY1R (0.45) NPY1RNPY2RPDE4BSLC6A4PDE4D

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-9624200-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2017-04-18 US disclosed
US-20150087645-A1 THERAPEUTIC PIPERAZINES HELICON THERAPEUTICS, INC. 2015-03-26 US disclosed
US-8927546-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2015-01-06 US disclosed
EP-2643000-A2 THERAPEUTIC PIPERAZINES Dart Neuroscience (Cayman) Ltd (KY) 2013-10-02 EP disclosed
WO-2012040258-A2 THERAPEUTIC PIPERAZINES HELICON THERAPEUTICS, INC. (US) 2012-03-29 WO disclosed
US-20110065691-A1 THERAPEUTIC PIPERAZINES DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2011-03-17 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 (2 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-20150087645-A1 THERAPEUTIC PIPERAZINES PDE4A, PDE4B, PDE4D NPY1R 229/4885NPY2R 226/4885ALOX15 1968/4885
US-20110065691-A1 THERAPEUTIC PIPERAZINES PDE4A, PDE4B, PDE4D NPY1R 229/4885NPY2R 226/4885ALOX15 1968/4885

“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.