SCHEMBL10544707

SCHEMBL10544707

N=C(N)N1CCN(C(=O)Cn2c(=O)sc3ccc(Cl)cc32)CC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 17/20 0.59
▸ TDP1 Q9NUW8 1/20 0.54
▸ GAA P10253 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TMEM97 Q5BJF2 1/20 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
SCHEMBL10547671 0.88 NPY5R (0.61) NPY5RGAATSHRNPSR1TMEM97
Hydrochloric Acid SCHEMBL10545744 0.87 NPY5R (0.60) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL10614797 0.85 NPY5R (0.62) NPY5RTMEM97
SCHEMBL13696444 0.84 NPY5R (0.61) NPY5RTDP1GAATSHRNPSR1
SCHEMBL10546335 0.84 NPY5R (0.59) NPY5RTDP1GAATSHRNPSR1
SCHEMBL10548940 0.84 NPY5R (0.59) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL10545705 0.84 NPY5R (0.62) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL10546635 0.84 NPY5R (0.61) NPY5RTMEM97
Hydrochloric Acid SCHEMBL10546343 0.84 NPY5R (0.56) NPY5RTMEM97
Hydrochloric Acid SCHEMBL10543860 0.83 NPY5R (0.58) NPY5RTDP1GAATSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4797399-A ANTIINFLAMMATORY AGENTS, ANTICOAGULANTS ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-10 — — US disclosed
EP-0232740-A1 N-containing fused heterocyclic compounds, processes for the preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-08-19 — — EP disclosed
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