SCHEMBL11664201

SCHEMBL11664201

CCOc1cccc(CC(C)N)c1OCCC(C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.40
PTGES O14684 1/20 0.40
ALOX5 P09917 1/20 0.40
PPARG P37231 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL14478203 0.77 L3MBTL1 (0.53) MAPTNPSR1L3MBTL1KMT2A
SCHEMBL2849222 0.77 ADRA2C (0.41) MCHR1HTTMAPTNPSR1L3MBTL1
SCHEMBL676358 0.75 MCHR1 (0.44) MCHR1PTGESALOX5PPARGHTT
SCHEMBL2848420 0.74 ADRA2C (0.43) MCHR1HTT
1-Isopentoxy-2-Ethoxybenzene SCHEMBL2844377 0.73 L3MBTL1 (0.56) MCHR1HTTMAPTNPSR1L3MBTL1
SCHEMBL3461154 0.73 ALDH1A1 (0.40) MCHR1PTGESALOX5PPARGHTT
SCHEMBL2844664 0.72 PTGES (0.42) MCHR1PTGESALOX5PPARGHTT
SCHEMBL729393 0.69 KMT2A (0.55) TAAR1KMT2A
SCHEMBL17420747 0.69 L3MBTL1 (0.46) MAPTNPSR1L3MBTL1KMT2A
SCHEMBL2849190 0.69 ALDH1A1 (0.42) MCHR1HTTL3MBTL1

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
US-4107165-A ANTICOAGULANTS ENDO LABORATORIES (US) 1978-08-15 US disclosed