SCHEMBL6693558

SCHEMBL6693558

CCCNC(=O)OOc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ALOX12 P18054 1/20 0.44
RECQL P46063 2/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL27572461 0.86 RAB9A (0.45) MAPTRECQLMTNR1AMTNR1BL3MBTL1
SCHEMBL1895641 0.82 TAAR1 (0.58)
SCHEMBL9462243 0.77 HPGD (0.56) RECQLTSHR
SCHEMBL7998297 0.76 RAB9A (0.60) MAPTRECQLMTNR1AMTNR1BL3MBTL1
SCHEMBL9662599 0.75 SMN1; SMN2 (0.52) MAPT
SCHEMBL10639479 0.73 OPRM1 (0.51) MTNR1AMTNR1B
SCHEMBL8744545 0.73 NAAA (0.47) MTNR1AMTNR1B
SCHEMBL30344909 0.73 ALDH1A1 (0.49) MTNR1AMTNR1BL3MBTL1
SCHEMBL577685 0.73 CES2 (0.44) MAPTRECQLMTNR1AMTNR1BL3MBTL1
SCHEMBL733157 0.72 LMNA (0.71) MAPTL3MBTL1

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-2004060367-A1 IMIDAZOLE AND TRIAZOLE DERIVATIVES USEFUL AS SELECTIVE COX-1 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-22 WO disclosed