SCHEMBL11224876

SCHEMBL11224876

O=Cc1cccc(Oc2ccc(Oc3ccc(Cl)cc3Cl)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.56
MRGPRX4 Q96LA9 1/20 0.55
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
HPGD P15428 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
NPC1 O15118 1/20 0.54
GAA P10253 1/20 0.54
RAB9A P51151 1/20 0.54
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
FFAR1 O14842 2/20 0.46
ADAMTS5 Q9UNA0 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
PPARG P37231 1/20 0.41
CYP1A1 P04798 1/20 0.41

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
SCHEMBL30715071 0.86 HPGD (0.55) MAPTKMT2AHPGDSMN1; SMN2NPC1
SCHEMBL11217503 0.86 HPGD (0.55) MAPTKMT2AHPGDSMN1; SMN2NPC1
SCHEMBL415226 0.86 HPGD (0.55) MAPTKMT2AHPGDSMN1; SMN2NPC1
SCHEMBL9265274 0.85 TTR (0.65) TTRMRGPRX4MAPTKMT2AHPGD
SCHEMBL24512660 0.82 TTR (0.60) TTRMAPTKMT2AHPGDSMN1; SMN2
SCHEMBL8546960 0.82 TTR (0.53) TTRMRGPRX4MAPTKMT2AHPGD
SCHEMBL5508642 0.81 MAPT (0.54) MAPTKMT2AHPGDSMN1; SMN2NPC1
SCHEMBL30758642 0.81 MAPT (0.54) MAPTKMT2AHPGDSMN1; SMN2NPC1
SCHEMBL18304466 0.81 MAPT (0.49) TTRMRGPRX4MAPTKMT2AHPGD
SCHEMBL19243059 0.81 MAOA (0.50) TTRMRGPRX4MAPTKMT2AHPGD

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-0052836-A1 Phenoxybenzaldehydes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-02 EP disclosed