SCHEMBL9048128

SCHEMBL9048128

C[CH]CCCc1ccccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.56
SLC16A3 O15427 10/20 0.49
TSHR P16473 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ALOX15 P16050 1/20 0.43
DHODH Q02127 1/20 0.41
CLCN2 P51788 1/20 0.41
HMGB1 P09429 1/20 0.40

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
SCHEMBL8615957 0.86 LMNA (0.41) FOLH1SLC16A3ALDH1A1
SCHEMBL31474045 0.83 FOLH1 (0.70) FOLH1SLC16A3TSHRALDH1A1ALOX15
SCHEMBL729909 0.83 FOLH1 (0.70) FOLH1SLC16A3TSHRALDH1A1ALOX15
SCHEMBL9345842 0.81 FOLH1 (0.68) FOLH1SLC16A3TSHRALDH1A1ALOX15
SCHEMBL9045795 0.81 HTT (0.37) FOLH1SLC16A3ALDH1A1
SCHEMBL9044047 0.81 CLCN2 (0.43) FOLH1SLC16A3ALDH1A1ALOX15CLCN2
SCHEMBL165530 0.80 FOLH1 (0.61) FOLH1SLC16A3TSHRALDH1A1ALOX15
SCHEMBL30365583 0.79 FOLH1 (0.76) FOLH1SLC16A3TSHRALDH1A1ALOX15
SCHEMBL70392 0.79 FOLH1 (0.76) FOLH1SLC16A3TSHRALDH1A1ALOX15
Bromide SCHEMBL3174157 0.79 FOLH1 (0.59) FOLH1SLC16A3TSHRALDH1A1ALOX15

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-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP disclosed