SCHEMBL6824364

SCHEMBL6824364

Cc1cc(C(=O)N2CCCC2)cnc1Cl

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 7/20 0.51
HPGD P15428 9/20 0.50
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
TSHR P16473 1/20 0.47
HSD11B1 P28845 1/20 0.46
CNR1 P21554 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL423103 0.97 GRM5 (0.48) GRM5HPGDKMT2AMEN1TSHR
SCHEMBL1427046 0.84 MEN1 (0.59) GRM5HPGDKMT2AMEN1TSHR
SCHEMBL423467 0.81 KMT2A (0.59) GRM5HPGDKMT2AMEN1TSHR
SCHEMBL6821163 0.80 HPGD (0.49) GRM5HPGDKMT2ATSHRCNR1
SCHEMBL23675259 0.80 HPGD (0.52) GRM5HPGDTSHRHSD11B1CNR1
SCHEMBL29994736 0.80 HPGD (0.52) GRM5HPGDTSHRHSD11B1CNR1
SCHEMBL990157 0.80 GRM5 (0.64) GRM5HPGDKMT2AMEN1
SCHEMBL20577446 0.76 GRM5 (0.54) GRM5HPGDHSD11B1CNR1
SCHEMBL13433926 0.76 HPGD (0.55) GRM5HPGDMAPK1
SCHEMBL427869 0.74 HCAR2 (0.47) KMT2AMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004074278-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2004-09-02 WO disclosed