SCHEMBL15519557

SCHEMBL15519557

CCN(CCc1noc(-c2ccc(F)cc2)n1)C(=O)c1cc(F)ccc1-c1ncccn1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 18/20 0.69
HCRTR2 O43614 18/20 0.69
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL15519767 0.94 HCRTR1 (0.71) HCRTR1HCRTR2NPC1RAB9ASMN1; SMN2
SCHEMBL15519701 0.93 HCRTR1 (0.61) HCRTR1HCRTR2ALDH1A1
SCHEMBL15518985 0.88 HCRTR1 (0.63) HCRTR1HCRTR2
SCHEMBL15522028 0.83 HCRTR2 (0.72) HCRTR1HCRTR2
SCHEMBL16648754 0.82 HCRTR1 (1.00) HCRTR1HCRTR2PPARGPPARA
SCHEMBL15519116 0.79 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL15520240 0.79 KDM4E (0.51) HCRTR1HCRTR2KDM4ENPC1ALDH1A1
SCHEMBL13833288 0.77 HCRTR1 (0.71) HCRTR1HCRTR2
SCHEMBL16648702 0.76 HCRTR1 (1.00) HCRTR1HCRTR2NPC1RAB9ASMN1; SMN2
SCHEMBL15521943 0.75 HCRTR1 (0.48) 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 1/4885KDM4E 1664/4885

“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.