SCHEMBL7966458

SCHEMBL7966458

CCCOc1ccc2cc(/C=C/C(=O)O)ccc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.63
POLB P06746 1/20 0.59
ALDH1A1 P00352 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
ABCG2 Q9UNQ0 1/20 0.52
THRB P10828 1/20 0.51
ATM Q13315 1/20 0.51
GAA P10253 2/20 0.51
AKR1C3 P42330 2/20 0.51
PPARA Q07869 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CYP1A1 P04798 1/20 0.48
CYP1B1 Q16678 1/20 0.48
PKM P14618 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL7966464 1.00 KDM4E (0.63) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL1481794 0.94 POLB (0.59) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL1481792 0.94 POLB (0.59) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7956711 0.92 POLB (0.56) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7956707 0.92 POLB (0.56) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7969916 0.90 PLA2G4A (0.57) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7969930 0.90 PLA2G4A (0.57) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7209884 0.90 PLA2G4A (0.57) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7970622 0.90 PLA2G4A (0.57) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A
SCHEMBL7969907 0.90 PLA2G4A (0.57) KDM4EPOLBALDH1A1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1213053-C Photocrosslinkable silane derivatives ROLIC AG (CH) 2005-08-03 CN disclosed
US-6277502-B1 ORGANOSILICON POLYMERS; LIQUID CRYSALS ROLIC AG (CH) 2001-08-21 US disclosed
CN-1195015-A Photocrosslinkable silane derivatives ROLIC AG (CH) 1998-10-07 CN disclosed