SCHEMBL8678035

SCHEMBL8678035

CCC(NC(=O)c1ccccc1)(Oc1ccc(OCCCc2ccccc2)c(C)c1C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CXCR2 P25025 1/20 0.40
SCN5A Q14524 2/20 0.39
SCN2A Q99250 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
PDE4A P27815 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4C Q08493 2/20 0.38
PDE4D Q08499 2/20 0.38
MTNR1B P49286 1/20 0.38
HDAC8 Q9BY41 1/20 0.38

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
SCHEMBL8678804 0.97 PDE4A (0.42) PPARGNPC1RAB9AMEN1KMT2A
SCHEMBL8677002 0.96 PDE4A (0.41) PPARGNPC1RAB9AMEN1KMT2A
SCHEMBL8679823 0.94 PPARA (0.40) PPARGNPC1RAB9AMEN1KMT2A
SCHEMBL8676570 0.85 SENP7 (0.42) PPARGNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL8678032 0.84 CXCR2 (0.44) PPARGNPC1RAB9AMEN1KMT2A
SCHEMBL8679799 0.83 MAPT (0.42) PPARGNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL8676393 0.82 MRGPRX4 (0.47) SMN1; SMN2NR1H4
SCHEMBL8678800 0.81 CXCR2 (0.45) PPARGCXCR2SCN5ASCN2ANPSR1
SCHEMBL8679540 0.81 PTGER1 (0.44) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL8677000 0.81 CXCR2 (0.44) PPARGCXCR2NPSR1PDE4APDE4B

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-5753641-A SYNERGISTIC THERAPY COMPRISING FINASTERIDE AND TERAZOSIN DRUGS MERCK & CO., INC. (US) 1998-05-19 US disclosed