SCHEMBL12294064

SCHEMBL12294064

COC(=O)/C(N)=C\C=C\N1CCOCC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.74
▸ ALDH1A1 P00352 6/20 0.51
▸ GAA P10253 1/20 0.51
▸ MAPT P10636 4/20 0.40
▸ USP2 O75604 3/20 0.40
▸ ALOX12 P18054 2/20 0.40
▸ NPC1 O15118 4/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ GLA P06280 1/20 0.33

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
SCHEMBL14095059 0.85 RECQL (1.00) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL20805869 0.83 RECQL (0.77) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL14653091 0.78 ALDH1A1 (0.55) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL17790100 0.78 RECQL (0.68) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL12294071 0.78 RECQL (0.68) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL23140711 0.78 RECQL (0.68) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL23140710 0.78 RECQL (0.68) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL14653120 0.76 RECQL (0.48) RECQLALDH1A1GAAKDM4E
SCHEMBL14613034 0.76 RECQL (0.67) RECQLALDH1A1GAAMAPTUSP2
SCHEMBL14653078 0.72 ALDH1A1 (0.46) RECQLALDH1A1GAA

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
WO-2011113719-A2 COMPOSITION COMPRISING A DIBENZOYLMETHANE SCREENING AGENT AND A MEROCYANINE DICYANO OR CYANOACETATE DERIVATIVE; METHOD FOR THE PHOTOSTABILIZATION OF THE DIBENZOYLMETHANE SCREENING AGENT L'OREAL (FR) 2011-09-22 — — WO disclosed
Send feedback