SCHEMBL7576068

SCHEMBL7576068

CC[SiH2][C@H]1CC[C@H](c2ccc(C(=O)Oc3ccc(F)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
PARP10 Q53GL7 2/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CYP2C9 P11712 1/20 0.37
PARP14 Q460N5 1/20 0.36
DGAT1 O75907 1/20 0.36
IDO1 P14902 1/20 0.36
LMNA P02545 1/20 0.36
DRD2 P14416 1/20 0.35
USP5 P45974 1/20 0.35

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
SCHEMBL7576076 1.00 KMT2A (0.41) KMT2AMEN1PARP10MAPTALDH1A1
SCHEMBL7575864 0.86 ALDH1A1 (0.36) KMT2APARP10MAPTALDH1A1SMN1; SMN2
SCHEMBL7575858 0.86 ALDH1A1 (0.36) KMT2APARP10MAPTALDH1A1SMN1; SMN2
SCHEMBL15181114 0.82 KMT2A (0.46) KMT2AMEN1PARP10MAPTALDH1A1
SCHEMBL7573254 0.82 AOC3 (0.36) KMT2AMAPTALDH1A1SMN1; SMN2CYP2C9
SCHEMBL7573248 0.82 AOC3 (0.36) KMT2AMAPTALDH1A1SMN1; SMN2CYP2C9
SCHEMBL7510568 0.82 CYP2C9 (0.59) KMT2AMEN1PARP10MAPTALDH1A1
SCHEMBL8045326 0.82 CYP2C9 (0.59) KMT2AMEN1PARP10MAPTALDH1A1
SCHEMBL10655306 0.80 CYP2C9 (0.50) KMT2AMEN1PARP10MAPTALDH1A1
SCHEMBL11132104 0.79 CYP2C9 (0.55) KMT2AMEN1PARP10MAPTALDH1A1

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
EP-0872484-B1 ORGANOSILICON COMPOUNDS, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT CHISSO CORP (JP) 2002-10-02 EP disclosed
US-5993690-A Organosilicon compound, liquid crystal composition, and liquid-crystal display element CHISSO CORPORATION (JP) 1999-11-30 US disclosed
EP-0872484-A1 ORGANOSILICON COMPOUNDS, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1998-10-21 EP disclosed