SCHEMBL14907930

SCHEMBL14907930

Cc1cccc(NC2OC(CO)C(O)C2O)c1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
GRK6 P43250 2/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SLC5A2 P31639 5/20 0.51
CA1 P00915 6/20 0.50
CA2 P00918 6/20 0.50

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
SCHEMBL11316345 0.84 NPC1 (0.54) TSHRGRK6NPC1RAB9ASLC5A2
SCHEMBL15563398 0.83 NPC1 (0.56) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL15563047 0.83 NPC1 (0.56) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL29054727 0.82 CA1 (0.55) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL7152297 0.82 NPC1 (0.74) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL6045363 0.82 NPC1 (0.74) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL7151149 0.82 NPC1 (0.74) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL9953680 0.82 NPC1 (0.74) TSHRNPC1RAB9ASLC5A2CA1
SCHEMBL30003604 0.81 TSHR (0.70) TSHRGRK6NPC1RAB9ASLC5A2
SCHEMBL6672229 0.81 TSHR (0.70) TSHRGRK6NPC1RAB9ASLC5A2

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-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2014-10-16 US disclosed
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2014-10-16 US disclosed
WO-2013063458-A2 INHIBITING G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2013-05-02 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-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides GRK6, GRK2, GRK3 TSHR 934/4885GRK6 1/4885NPC1 4217/4885

“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.