SCHEMBL9212419

SCHEMBL9212419

CCCCCCCNC(=O)c1[nH]c2ccccc2c1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.62
USP2 O75604 1/20 0.58
KDM4E B2RXH2 4/20 0.55
ALDH1A1 P00352 3/20 0.55
HPGD P15428 2/20 0.55
NAAA Q02083 2/20 0.53
MAP2 P11137 1/20 0.52
HSD17B10 Q99714 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALOX15 P16050 2/20 0.46

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
SCHEMBL5276134 0.81 USP2 (0.61) GAAUSP2KDM4EALDH1A1HPGD
SCHEMBL6353285 0.79 GAA (0.72) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL24073027 0.79 GAA (0.60) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL24073014 0.79 GAA (0.60) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL7566685 0.77 GAA (1.00) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL7566792 0.77 GAA (0.57) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL7529957 0.77 GAA (0.57) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL4926259 0.76 ALDH1A1 (0.56) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL2760046 0.76 MAP2 (0.59) GAAKDM4EALDH1A1HPGDMAP2
SCHEMBL9218552 0.76 NAAA (0.53) USP2ALDH1A1NAAAHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0512570-B1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1995-10-11 EP disclosed
EP-0512570-A1 Urea derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-11-11 EP disclosed