SCHEMBL5778637

SCHEMBL5778637

COCCc1nc2cc(C(=O)O)ccc2n1-c1cccc(N2CCN(Cc3ccccc3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
MAPT P10636 6/20 0.45
HSD17B10 Q99714 4/20 0.45
KDM4E B2RXH2 3/20 0.45
TSHR P16473 3/20 0.45
TP53 P04637 1/20 0.45
GLP1R P43220 2/20 0.43
DRD2 P14416 2/20 0.43
DRD3 P35462 1/20 0.43
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 3/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
CRBN Q96SW2 1/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL4703168 0.90 THRB (0.48) THRBMAPTHSD17B10TSHRGLP1R
SCHEMBL5781185 0.90 THRB (0.48) THRBHSD17B10GLP1RHPGDKMT2A
SCHEMBL5779114 0.90 THRB (0.47) THRBMAPTHSD17B10TSHRGLP1R
SCHEMBL5779164 0.89 CRBN (0.45) THRBMAPTHSD17B10TSHRGLP1R
SCHEMBL5777980 0.88 THRB (0.49) THRBHSD17B10LMNAHPGDKMT2A
SCHEMBL5781244 0.88 THRB (0.41) THRBMAPTHSD17B10KDM4ETSHR
SCHEMBL5783864 0.88 THRB (0.46) THRBMAPTHSD17B10TSHRHPGD
SCHEMBL5783447 0.88 HPGD (0.46) THRBHSD17B10TSHRGLP1RHPGD
SCHEMBL5783074 0.87 THRB (0.45) THRBHSD17B10KDM4EGLP1RHPGD
SCHEMBL5782047 0.87 THRB (0.45) THRBHSD17B10GLP1RHPGDKMT2A

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