SCHEMBL15519928

SCHEMBL15519928

O=C(NCCc1ccn(-c2ccc(F)cn2)n1)c1ccc(F)cc1-n1nccn1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 16/20 0.47
HCRTR2 O43614 16/20 0.47
HCAR2 Q8TDS4 1/20 0.36
PDE10A Q9Y233 1/20 0.36
NAMPT P43490 1/20 0.35
AR P10275 1/20 0.35

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
SCHEMBL15519621 0.83 HCRTR1 (0.43) HCRTR1HCRTR2HCAR2
SCHEMBL15521906 0.82 HCRTR1 (0.44) HCRTR1HCRTR2HCAR2PDE10ANAMPT
SCHEMBL15518972 0.80 HCRTR1 (0.62) HCRTR1HCRTR2
SCHEMBL15519023 0.78 HCAR2 (0.43) HCRTR1HCRTR2HCAR2PDE10ANAMPT
SCHEMBL15519931 0.76 HCRTR1 (0.53) HCRTR1HCRTR2
SCHEMBL15519454 0.75 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL15519053 0.74 HCRTR2 (0.48) HCRTR1HCRTR2
SCHEMBL15519376 0.73 HCRTR1 (0.39) HCRTR1HCRTR2HCAR2NAMPTAR
SCHEMBL15520474 0.72 HCRTR1 (0.50) HCRTR1HCRTR2HCAR2
SCHEMBL15519028 0.72 HCRTR1 (0.62) HCRTR1HCRTR2

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 HCRTR1 2/4885HCRTR2 1/4885HCAR2 53/4885

“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.