SCHEMBL6475849

SCHEMBL6475849

CCOC(=O)N(c1ccncc1)c1ccc2c([c]cn2Cc2ccc(F)cc2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ OPRD1 P41143 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ THRB P10828 1/20 0.34
▸ PTGIR P43119 2/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ P2RX7 Q99572 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32

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
SCHEMBL6482645 0.93 OPRD1 (0.35) MMP13MAPTKDM4EPKMOPRD1
SCHEMBL6475851 0.86 MAPK14 (0.39) MMP13MAPTKDM4EPKMOPRD1
SCHEMBL6474711 0.78 CYP19A1 (0.38) OPRD1PTGIRKCNH2HRH3
SCHEMBL5533097 0.77 PDE4A (0.38) MAPTKDM4EPKMALDH1A1POLB
SCHEMBL5531063 0.76 MEN1 (0.36) MAPTKDM4EPKMPOLBTHRB
SCHEMBL27489900 0.66 PTGIR (0.55) MAPTL3MBTL1ALDH1A1PTGIRMEN1
SCHEMBL7057720 0.63 THRB (0.59) MAPTALDH1A1POLBTHRBMEN1
SCHEMBL2117187 0.62 CD74 (0.40) MAPTKDM4EL3MBTL1ALDH1A1HTT
SCHEMBL3849945 0.62 ALDH1A1 (0.46) MAPTKDM4EALDH1A1POLBHTT
SCHEMBL832502 0.61 NOD2 (0.57) MAPTKDM4EPKMALDH1A1POLB

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-6919344-B2 N-substituted indole-3-glyoxylamides having anti-asthmatic, antiallergic and immunosuppressant/immuno-modulating action ASTA MEDICA, AKTIENGESELLSCHAFT (DE) 2005-07-19 — — US disclosed
US-6344467-B1 ANTIASTHMATIC, ANTIALLERGIC AND IMMUNOSUPPRESSANT/IMMUNOMODULATING PROPERTIES ASTA MEDICA AG (DE) 2002-02-05 — — US disclosed
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