SCHEMBL7966543

SCHEMBL7966543

CCCCCCCCOc1cc(-c2ccc(/C=C/C(=O)O)cc2)ccc1OC

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
ACHE P22303 4/20 0.58
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HSD17B10 Q99714 1/20 0.54
SMPD1 P17405 3/20 0.54
GAA P10253 1/20 0.54
KMT2A Q03164 1/20 0.54
CNR2 P34972 3/20 0.52
SNCA P37840 1/20 0.51
PTPN11 Q06124 1/20 0.51
PDE4A P27815 1/20 0.50
PDE4B Q07343 1/20 0.50
PDE4C Q08493 1/20 0.50
PDE4D Q08499 1/20 0.50
AKR1C3 P42330 1/20 0.50

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
SCHEMBL7973450 1.00 KDM4E (0.61) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7966546 1.00 KDM4E (0.61) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7973457 1.00 KDM4E (0.61) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7967539 0.95 KDM4E (0.68) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7966534 0.95 KDM4E (0.68) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7966530 0.95 KDM4E (0.68) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7967532 0.95 KDM4E (0.68) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7966711 0.90 KDM4E (0.74) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL7966717 0.90 KDM4E (0.74) KDM4EACHEALDH1A1HPGDALOX15
SCHEMBL8085980 0.89 KDM4E (0.76) KDM4EACHEALDH1A1HPGDALOX15

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
US-6277502-B1 ORGANOSILICON POLYMERS; LIQUID CRYSALS ROLIC AG (CH) 2001-08-21 US disclosed