SCHEMBL10112975

SCHEMBL10112975

CCCCc1ccc(NC(=O)Oc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.67
RAB9A P51151 1/20 0.65
ALDH1A1 P00352 5/20 0.61
MAPT P10636 3/20 0.61
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
THRB P10828 2/20 0.60
HPGD P15428 2/20 0.60
TRPV1 Q8NER1 1/20 0.59
KDM4E B2RXH2 1/20 0.57
GFER P55789 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
RAD51 Q06609 1/20 0.56
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
GAA P10253 1/20 0.56
POLB P06746 1/20 0.55
ADRB1 P08588 1/20 0.54
ADRB3 P13945 1/20 0.54

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
SCHEMBL7339580 0.94 FAAH (0.72) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL29233073 0.94 RAB9A (0.74) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL29233062 0.90 RAB9A (0.72) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL29233138 0.89 RAB9A (0.70) FAAHRAB9AALDH1A1THRBTRPV1
SCHEMBL1839911 0.89 RAB9A (0.70) FAAHRAB9AALDH1A1THRBTRPV1
SCHEMBL29233089 0.89 RAB9A (0.70) FAAHRAB9AALDH1A1THRBTRPV1
SCHEMBL5657473 0.86 ALDH1A1 (0.57) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL6378629 0.85 RAB9A (0.54) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL12218372 0.85 RAB9A (0.78) FAAHRAB9AALDH1A1MAPTMEN1
SCHEMBL12549885 0.85 RAB9A (0.88) FAAHRAB9AALDH1A1MAPTMEN1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101898982-B Npy y5 antagonists SHIONOGI & CO 2012-07-04 CN disclosed
US-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-20110039802-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2011-02-17 US disclosed
CN-101898982-A NPY Y5 antagonist SHIONOGI & CO 2010-12-01 CN disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 US disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 US disclosed
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US disclosed
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US disclosed
CN-1391469-B NPY Y5 antagonists SHIONOGI & CO 2010-05-26 CN disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 US disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 US disclosed
CN-1391469-A NPYY5 antagonists SHIONOGI & CO (JP) 2003-01-15 CN 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 (3 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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R FAAH 974/4885RAB9A 3699/4885ALDH1A1 4558/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R FAAH 994/4885RAB9A 3651/4885ALDH1A1 4599/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R FAAH 974/4885RAB9A 3820/4885ALDH1A1 4517/4885

“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.