SCHEMBL6229802

SCHEMBL6229802

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/[CH]O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
MAPT P10636 2/20 0.61
ALDH1A1 P00352 2/20 0.61
MEN1 O00255 2/20 0.61
CYP3A4 P08684 2/20 0.61
ALOX15 P16050 2/20 0.61
UGT1A1 P22309 1/20 0.61
SQLE Q14534 7/20 0.59
KDM4E B2RXH2 1/20 0.55
NR1I2 O75469 1/20 0.52
LMNA P02545 1/20 0.52
PGR P06401 1/20 0.52

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
SCHEMBL9953423 1.00 KMT2A (0.70) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL10707285 0.95 ALDH1A1 (0.64) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL10711405 0.95 ALDH1A1 (0.64) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL109310 0.84 KMT2A (0.73) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL29059665 0.84 KMT2A (0.73) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL2841894 0.84 KMT2A (0.73) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL2896117 0.84 KMT2A (0.73) KMT2AMAPTALDH1A1MEN1CYP3A4
SCHEMBL23802597 0.83 KMT2A (1.00) KMT2AMAPTALDH1A1MEN1CYP3A4
Squalene SCHEMBL8819997 0.83 KMT2A (1.00) KMT2AMAPTALDH1A1MEN1CYP3A4
Squalene SCHEMBL890053 0.83 KMT2A (1.00) KMT2AMAPTALDH1A1MEN1CYP3A4

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-0733709-B1 Mutated farnesyldiphosphate synthase capable of synthesizing geranylgeranyldiphosphate and gene coding therefor TOYOTA MOTOR CO LTD (JP) 2005-05-11 EP claimed