SCHEMBL1926093

SCHEMBL1926093

O=C(O)N(Cc1ccccc1)c1ccccc1O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.51
TRPM8 Q7Z2W7 2/20 0.50
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
HTT P42858 1/20 0.47
PAX8 Q06710 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDK1 Q15118 1/20 0.46
TSPO P30536 1/20 0.44
GAA P10253 1/20 0.43
POLB P06746 1/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43

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
Bromide SCHEMBL5447049 0.87 PDK1 (0.48) TSHRTRPM8PDK1TSPO
SCHEMBL5881190 0.81 TSHR (0.50) TSHRTRPM8ALDH1A1GLAHTT
SCHEMBL1927016 0.79 ALDH1A1 (0.69) TSHRTRPM8NPC1RAB9AALDH1A1
SCHEMBL1925149 0.79 TDP1 (0.53) TSHRTRPM8NPC1RAB9AALDH1A1
SCHEMBL5881182 0.78 TP53 (0.42) TSHRTRPM8ALDH1A1GLA
SCHEMBL22118149 0.78 TSHR (0.47) TSHRALDH1A1
SCHEMBL1259310 0.77 PDK1 (0.58) TSHRTRPM8NPC1RAB9AALDH1A1
SCHEMBL7162154 0.77 TSHR (0.41) TSHRALDH1A1SMN1; SMN2POLB
SCHEMBL3606825 0.76 ACHE (0.47) TSHRTRPM8NPC1RAB9AALDH1A1
SCHEMBL11509877 0.76 TSHR (0.46) TSHRTRPM8NPC1RAB9AALDH1A1

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-1300407-B2 CARBAMATES DERIVED FROM ARYLALKYLAMINES S A L V A T LAB SA (ES) 2011-06-08 EP claimed