SCHEMBL3399767

SCHEMBL3399767

Cc1nc(-c2ccc(Cl)cc2Cl)sc1C(=O)N1CCC(N2CCCCCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.50
ACKR3 P25106 1/20 0.50
HRH3 Q9Y5N1 2/20 0.48
L3MBTL1 Q9Y468 5/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HSP90AA1 P07900 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
LRRK2 Q5S007 1/20 0.45
DPP4 P27487 1/20 0.45
DPP8 Q6V1X1 1/20 0.45
L3MBTL3 Q96JM7 5/20 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
SCHEMBL3405780 1.00 HTR2C (0.50) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL3400371 0.92 HTR2C (0.50) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL3398930 0.92 HTR2C (0.50) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL3402555 0.92 HTR2C (0.50) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL13071979 0.92 HTR2C (0.50) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL3397030 0.91 HTR2C (0.46) HTR2CL3MBTL1KDM4EMAPTMEN1
SCHEMBL3402711 0.90 ACKR3 (0.49) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL3403453 0.90 ACKR3 (0.49) HTR2CACKR3HRH3L3MBTL1KDM4E
SCHEMBL13071743 0.88 HTR2C (0.60) HTR2CHRH3L3MBTL1MAPTALDH1A1
SCHEMBL3405116 0.88 HTR2C (0.60) HTR2CHRH3L3MBTL1MAPTALDH1A1

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-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
WO-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 WO disclosed