SCHEMBL9014124

SCHEMBL9014124

C=CCc1cccc(C=C=C=Cc2cccc(CC=C)c2O)c1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.59
GABRB2 P47870 2/20 0.59
KMT2A Q03164 7/20 0.52
MEN1 O00255 6/20 0.52
LMNA P02545 4/20 0.52
ALDH1A1 P00352 2/20 0.52
AKR1B1 P15121 1/20 0.50
MAPT P10636 6/20 0.49
GAA P10253 4/20 0.49
KDM4E B2RXH2 3/20 0.49
CASP1 P29466 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ALOX12 P18054 2/20 0.48
MAPK1 P28482 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 3/20 0.44
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL433429 0.83 GABRA1 (0.66) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL10041813 0.81 GABRA1 (0.63) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL168974 0.80 GABRA1 (0.79) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL617923 0.80 GABRA1 (0.61) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL29952629 0.80 GABRA1 (0.61) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL7171833 0.77 KMT2A (0.62) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL6823137 0.77 KMT2A (0.62) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL14433461 0.77 GABRA1 (0.58) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL9013928 0.77 GABRA1 (0.58) GABRA1GABRB2KMT2AMEN1LMNA
SCHEMBL18657312 0.76 KMT2A (0.62) GABRA1GABRB2KMT2AMEN1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743937-A1 BIS-(ALKYLSALICYLIDENE)ETHYLENE OR PHENYLENE DIAMINES AND TRANSITION METAL COMPLEXES THEREOF HENKEL CORPORATION (US) 1996-11-27 EP disclosed
WO-1995021152-A1 BIS-(ALKYLSALICYLIDENE)ETHYLENE OR PHENYLENE DIAMINES AND TRANSITION METAL COMPLEXES THEREOF HENKEL CORPORATION (US) 1995-08-10 WO disclosed