SCHEMBL5783447

SCHEMBL5783447

COCCc1nc2cc(C(=O)O)ccc2n1-c1cccc(N2CCN(CC(N)=O)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.46
THRB P10828 1/20 0.46
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 2/20 0.41
CRBN Q96SW2 3/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
PTGER4 P35408 1/20 0.39
HCAR3 P49019 1/20 0.38
GLP1R P43220 1/20 0.37
HTR1A P08908 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
SCHEMBL5779114 0.93 THRB (0.47) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5783864 0.91 THRB (0.46) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5781185 0.90 THRB (0.48) HPGDTHRBHSD17B10KMT2AMEN1
SCHEMBL4703168 0.90 THRB (0.48) HPGDTHRBHSD17B10KMT2AMEN1
SCHEMBL5779153 0.89 HPGD (0.49) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5780883 0.88 THRB (0.43) HPGDTHRBHSD17B10KMT2AALDH1A1
SCHEMBL5780735 0.88 THRB (0.43) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5777910 0.88 THRB (0.43) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5777980 0.88 THRB (0.49) HPGDTHRBHSD17B10KMT2ACRBN
SCHEMBL5778637 0.88 THRB (0.46) HPGDTHRBHSD17B10KMT2ACRBN

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
EP-1194410-B1 BENZIMIDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THESE COMPOUNDS NEUROSEARCH AS (DK) 2006-01-18 EP claimed