SCHEMBL8773598

SCHEMBL8773598

N#C/C(=C/C=C/c1ccccc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.76
LMNA P02545 4/20 0.68
KDM4E B2RXH2 3/20 0.68
ALDH1A1 P00352 2/20 0.68
HPGD P15428 2/20 0.68
HTT P42858 1/20 0.68
MAPT P10636 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
KMT2A Q03164 1/20 0.64
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
GAA P10253 1/20 0.52
MAOB P27338 5/20 0.50
CISD1 Q9NZ45 1/20 0.46
SLC16A3 O15427 1/20 0.46
CYP3A4 P08684 1/20 0.46
SLC16A1 P53985 1/20 0.46
GPR35 Q9HC97 1/20 0.46

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
SCHEMBL15082 1.00 MCL1 (0.76) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL15081 1.00 MCL1 (0.76) MCL1LMNAKDM4EALDH1A1HPGD
Ammonia Solution, Strong SCHEMBL434911 0.98 MCL1 (0.73) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL9361177 0.93 MCL1 (0.67) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL9361168 0.93 MCL1 (0.67) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL9508065 0.93 MCL1 (0.65) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL14889223 0.90 MCL1 (0.71) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL10938245 0.90 MCL1 (0.62) MCL1LMNAKDM4EALDH1A1HPGD
SCHEMBL10936802 0.89 MCL1 (0.76) MCL1LMNAKDM4EALDH1A1HPGD
Allylamine SCHEMBL2214884 0.88 MCL1 (0.65) MCL1LMNAKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550239-B1 Storage stable curable organosiloxane compositions containing a microencapsulated catalyst and method for preparing said catalyst DOW CORNING (US) 1997-09-10 EP disclosed
US-5279898-A Hydrosilation catalyst DOW CORNING CORPORATION (US) 1994-01-18 US disclosed
EP-0550239-A1 Storage stable heat curable organosiloxane compositions containing a microencapsulated catalyst and method for preparing said catalyst DOW CORNING CORPORATION (US) 1993-07-07 EP disclosed
US-5194460-A Crosslinked organosiloxane compound containing platinum group catalyst; optically transparent DOW CORNING CORPORATION (US) 1993-03-16 US disclosed
US-4263394-A Aqueous alkaline soluble photopolymerizable material VICKERS LIMITED (GB) 1981-04-21 US disclosed