SCHEMBL15520281

SCHEMBL15520281

O=C(NCCc1noc(-c2ccc(F)cn2)n1)c1ccccc1-n1nccn1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 18/20 0.53
HCRTR1 O43613 17/20 0.53
PDE10A Q9Y233 1/20 0.41

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
SCHEMBL13833187 0.88 HCRTR1 (0.65) HCRTR2HCRTR1
SCHEMBL15519358 0.87 HCRTR1 (0.60) HCRTR2HCRTR1PDE10A
SCHEMBL15522063 0.83 HCRTR1 (0.57) HCRTR2HCRTR1
SCHEMBL15521964 0.81 HCRTR1 (0.62) HCRTR2HCRTR1
SCHEMBL15520879 0.81 HCRTR1 (0.50) HCRTR2HCRTR1PDE10A
SCHEMBL16648787 0.77 HCRTR1 (0.85) HCRTR2HCRTR1
SCHEMBL15519053 0.76 HCRTR2 (0.48) HCRTR2HCRTR1
SCHEMBL15519484 0.74 HCRTR1 (0.63) HCRTR2HCRTR1PDE10A
SCHEMBL15521960 0.74 HCRTR1 (0.70) HCRTR2HCRTR1
SCHEMBL13833377 0.73 HCRTR1 (0.73) HCRTR2HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140081025-A1 HETEROAROMATIC RING DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-03-20 US disclosed
US-20140081025-A1 HETEROAROMATIC RING DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-03-20 US disclosed
US-20140081025-A1 HETEROAROMATIC RING DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-03-20 US disclosed
EP-2708537-A1 HETEROAROMATIC RING DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2014-03-19 EP 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-20140081025-A1 HETEROAROMATIC RING DERIVATIVE HCRTR2, HCRTR1, HTT HCRTR2 1/4885HCRTR1 2/4885PDE10A 2807/4885

“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.